data_1xsc_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 1xsc _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.594 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.214 0.53 . . . . 0.0 111.399 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.608 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -106.53 139.2 41.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.788 -179.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.37 125.37 33.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.13 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -136.09 167.01 22.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -157.83 123.89 4.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.079 0.466 . . . . 0.0 111.18 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.507 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.7 169.72 13.14 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.035 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.477 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -124.64 117.75 24.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.63 0.252 . . . . 0.0 111.596 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.445 HG13 ' HB3' ' A' ' 98' ' ' TYR . 23.7 mt -85.95 91.99 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.603 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 26.1 mt -82.46 146.02 7.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.874 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.609 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 45.8 p90 -150.04 125.2 10.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.701 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.408 ' HG2' HG21 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -88.77 113.53 24.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.798 0.332 . . . . 0.0 110.343 178.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 18' ' ' ARG . 12.6 ttp180 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.151 0 CA-C-O 120.92 0.391 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.496 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -105.76 148.03 10.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.329 0.585 . . . . 0.0 111.847 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.609 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 8.4 mt-10 -122.34 173.78 7.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.863 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 34.0 m-85 -138.55 133.56 32.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.63 0.252 . . . . 0.0 111.35 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.603 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.2 tp -76.8 133.21 39.46 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.413 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.4 mt -132.98 144.53 50.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.98 0.419 . . . . 0.0 111.019 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 54.3 mt -123.13 116.54 23.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.464 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 7.5 tt0 -74.55 132.35 41.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.184 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.04 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.785 0.326 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.475 ' CE2' HD22 ' A' ' 130' ' ' LEU . 72.6 m95 -108.27 123.09 48.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.4 p -147.11 151.28 40.72 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.741 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.472 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 41.7 Cg_endo -66.79 168.3 17.25 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.493 2.128 . . . . 0.0 111.86 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.549 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 36.1 Cg_exo -60.3 99.53 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.588 2.192 . . . . 0.0 112.775 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 4.4 pttt -106.83 140.1 40.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.683 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.36 178.42 16.76 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.628 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.71 94.22 5.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.791 0.329 . . . . 0.0 110.666 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.465 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.7 p -69.56 132.13 33.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.068 0.461 . . . . 0.0 111.031 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.553 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.3 tt0 -95.35 151.88 38.96 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.119 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.3 Cg_endo -49.38 -33.08 28.18 Favored 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.682 2.255 . . . . 0.0 112.585 -179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.513 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -90.4 -13.38 60.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.345 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -87.67 165.12 15.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.553 0.216 . . . . 0.0 110.528 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.87 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 33.8 t70 -82.79 161.34 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.078 0.466 . . . . 0.0 110.711 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.5 -63.62 1.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.436 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.5 tp -61.87 -40.12 94.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.491 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.87 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -50.81 -50.06 57.14 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.465 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 86.7 m -54.88 -36.81 65.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.22 -32.09 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.043 178.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.437 HD23 ' HB1' ' A' ' 72' ' ' ALA . 93.9 mt -72.03 -53.03 14.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.641 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -59.02 -43.61 91.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.416 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.573 ' HB1' ' HE2' ' A' ' 67' ' ' GLU . . . -58.62 -33.61 70.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.549 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 27.2 m -62.93 -53.78 48.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.328 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.485 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.4 pt20 -74.17 -23.05 59.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.726 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.47 -37.46 36.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.573 ' HE2' ' HB1' ' A' ' 63' ' ' ALA . 1.3 mp0 -110.07 9.84 24.1 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.81 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -153.25 -14.55 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.527 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 80.2 -6.41 60.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.485 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.6 mt -98.03 127.41 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.8 pt-20 -107.5 170.3 8.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.497 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.62 -31.34 10.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.9 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.46 -21.03 79.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.184 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -97.38 -5.6 35.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.648 0.261 . . . . 0.0 111.069 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -131.03 -167.82 1.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.781 0.324 . . . . 0.0 110.292 179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.509 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -140.02 97.48 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.897 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 101' ' ' ALA . 9.2 mm -70.77 112.83 6.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.018 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.97 134.6 29.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -94.26 151.28 19.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.36 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.81 -21.98 40.14 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.524 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.465 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 18.9 t80 -106.29 126.55 52.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.798 0.333 . . . . 0.0 110.869 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.471 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.75 125.97 5.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.083 0.468 . . . . 0.0 111.55 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.633 HH12 ' HE2' ' A' ' 84' ' ' GLU . 8.0 tpt85 -152.45 136.47 16.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.905 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.638 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -118.74 143.9 46.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.082 0.468 . . . . 0.0 111.651 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.469 HD12 ' HE2' ' A' ' 98' ' ' TYR . 3.8 mt -100.47 124.73 46.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.137 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -114.95 120.17 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.021 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 9.0 p90 -167.07 144.83 4.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.122 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 10.9 p -83.99 109.0 16.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.78 -93.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.433 ' HG3' ' OD1' ' A' ' 91' ' ' ASN . 12.8 ptt85 -74.8 -48.17 26.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.857 0.36 . . . . 0.0 110.351 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.433 ' OD1' ' HG3' ' A' ' 90' ' ' ARG . 20.2 p-10 -171.47 30.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.669 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.608 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.37 125.58 2.65 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.557 179.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.594 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 52.6 Cg_endo -68.08 117.79 5.17 Favored 'Trans proline' 0 CA--C 1.513 -0.571 0 C-N-CA 123.273 2.649 . . . . 0.0 112.816 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.483 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -101.5 124.35 47.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.741 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.7 m -90.53 112.04 23.57 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.638 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 32.5 t -109.06 108.96 26.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.642 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.599 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.68 142.89 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.472 ' CE1' ' HG2' ' A' ' 45' ' ' PRO . 7.7 m-85 -126.3 133.61 51.36 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.477 ' HB2' HD22 ' A' ' 13' ' ' LEU . 14.5 m-90 -124.07 143.34 50.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.444 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.465 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -80.96 128.53 33.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.224 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -134.43 142.17 47.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.178 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 10.9 tt0 -119.5 115.28 23.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.646 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.552 HG11 HD23 ' A' ' 75' ' ' LEU . 11.9 m -72.24 129.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 121.304 0.574 . . . . 0.0 110.653 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' CD ' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.69 -27.1 68.46 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.794 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.434 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 1.3 m-20 -106.35 132.77 52.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.111 0.481 . . . . 0.0 111.969 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -69.09 -43.25 74.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.458 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -100.21 24.02 9.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.811 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.434 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 2.9 p -41.89 147.22 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.75 144.64 54.37 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.306 0.574 . . . . 0.0 110.768 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.57 ' CG2' HD21 ' A' ' 112' ' ' LEU . 30.5 mm -124.26 96.81 4.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.928 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.527 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 15.2 mtp180 -106.77 99.77 9.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.97 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.57 HD21 ' CG2' ' A' ' 110' ' ' ILE . 8.3 mt -85.68 172.86 10.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.528 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.11 -172.72 2.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.847 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -60.13 -29.57 68.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.09 -6.98 52.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.779 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.437 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 52.9 m80 -142.05 127.88 19.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.0 110.995 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.26 -18.94 15.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.513 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.03 163.67 39.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 111.43 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.492 ' CE2' HG13 ' A' ' 110' ' ' ILE . 38.5 p90 -138.25 175.16 9.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.713 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.421 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 4.1 mtt85 -158.68 158.66 34.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 0.0 111.509 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 87.5 m95 -127.1 106.74 9.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.62 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 31' ' ' PHE . 0.1 OUTLIER -138.15 167.62 21.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.066 0.46 . . . . 0.0 111.585 -178.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.74 -153.51 3.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.707 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.03 -46.69 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.843 0.322 . . . . 0.0 110.845 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.2 pt-20 -56.14 -49.34 74.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.724 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.9 -50.68 22.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.551 -179.503 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.413 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -50.38 -29.63 10.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 2.3 m -83.94 -33.94 24.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.392 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.724 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.29 -41.43 94.12 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.585 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.55 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -77.6 -44.33 28.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.88 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.88 52.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.142 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.401 ' O ' ' HE3' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -37.8 -34.11 0.1 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.131 -179.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -54.8 114.77 1.84 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.127 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -45.8 -50.81 13.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.519 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.423 ' CB ' HD11 ' A' ' 85' ' ' LEU . 11.3 mp0 -46.03 -46.97 16.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.624 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.448 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -71.36 -45.24 63.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.696 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.61 -30.24 12.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.518 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -79.77 -47.01 15.94 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.842 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.47 63.6 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.032 0.444 . . . . 0.0 110.423 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.86 -27.67 61.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.024 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.518 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.19 -51.45 53.42 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.639 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -67.06 -30.74 70.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.55 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.5 -56.62 22.66 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.948 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -67.78 -28.26 67.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.771 0.319 . . . . 0.0 110.45 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -68.55 -43.71 76.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -72.67 -52.58 14.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.256 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.475 HD11 ' CZ ' ' A' ' 16' ' ' PHE . 32.2 mt -52.23 -34.84 47.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.658 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.53 0.2 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.264 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.593 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.497 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -104.11 127.82 51.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.113 -179.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 121.83 25.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.024 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -138.74 160.52 39.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.827 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.9 m -148.19 123.66 10.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.237 0.541 . . . . 0.0 111.146 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.85 170.94 13.45 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.678 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.408 HD23 HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -124.67 117.24 23.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.859 0.361 . . . . 0.0 110.798 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.575 HG13 ' HB3' ' A' ' 98' ' ' TYR . 62.8 mt -82.87 92.32 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 26.1 mt -82.64 145.73 8.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.186 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.653 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 29.0 p90 -149.62 124.08 9.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.837 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.619 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -87.12 113.51 22.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.4 . . . . 0.0 110.654 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.316 -179.702 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.917 0.389 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.653 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.0 mt -101.17 148.33 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.616 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 16.8 mp0 -134.86 134.27 40.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.725 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.584 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -96.35 150.04 21.03 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.9 tp -82.97 135.93 34.71 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.098 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.2 mt -135.54 142.65 45.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.868 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 mt -123.29 113.63 19.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.08 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.488 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.9 tt0 -69.09 122.26 18.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.426 179.363 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 120.817 0.341 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.658 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 10.1 m95 -95.84 139.21 32.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.05 136.64 9.41 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.748 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -49.17 169.08 0.11 Allowed 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.781 1.654 . . . . 0.0 111.018 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.687 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 1.5 Cg_endo -78.16 101.06 1.43 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.027 1.818 . . . . 0.0 112.141 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.88 -173.11 2.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.46 -139.41 2.67 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.352 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -131.57 127.23 36.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.531 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 0.2 OUTLIER -81.6 135.51 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-O 120.95 0.405 . . . . 0.0 110.599 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -87.18 170.43 12.1 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.004 -179.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 76.8 Cg_exo -49.68 -63.29 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.793 2.328 . . . . 0.0 112.87 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.9 19.27 42.77 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.432 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.442 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 30.5 tt0 -90.6 160.77 15.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.976 0.388 . . . . 0.0 110.754 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.878 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -85.31 162.69 18.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.057 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.524 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -72.13 -62.98 1.24 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.086 0.47 . . . . 0.0 110.737 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.455 ' HG ' ' HG ' ' A' ' 61' ' ' LEU . 21.9 tp -61.97 -42.53 99.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.316 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.878 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.2 mt-10 -50.35 -46.87 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.73 0.3 . . . . 0.0 110.516 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.531 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 87.6 m -54.63 -37.36 65.56 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.09 -32.74 50.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.122 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.455 ' HG ' ' HG ' ' A' ' 57' ' ' LEU . 95.2 mt -70.95 -53.46 14.84 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.73 -38.86 89.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.038 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.53 -33.79 76.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.045 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.687 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 90.0 m -58.55 -51.92 67.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.393 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.531 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.63 -20.96 61.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.919 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.67 -41.67 30.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.755 0.312 . . . . 0.0 111.17 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.08 6.34 26.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.614 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -148.24 -7.96 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.608 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 70.95 -1.94 20.87 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.143 -1.027 . . . . 0.0 113.241 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.531 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.4 mt -100.92 127.67 53.86 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.042 0 CA-C-N 117.035 0.418 . . . . 0.0 110.811 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.42 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.1 pm0 -108.32 166.6 10.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.12 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.54 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.71 -34.55 5.24 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.734 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.41 -23.78 77.24 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.292 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.493 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 2.9 mm-40 -93.72 -5.83 47.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.395 0.14 . . . . 0.0 111.233 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.54 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.42 -171.35 2.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.996 0.427 . . . . 0.0 110.64 178.775 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.8 m -138.98 99.02 3.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.408 HD11 HD23 ' A' ' 13' ' ' LEU . 7.6 mm -71.58 120.38 19.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.443 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.33 131.33 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.221 0.534 . . . . 0.0 110.937 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -90.59 148.81 22.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.211 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.72 -24.32 30.03 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.285 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -103.71 125.62 50.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.691 0.282 . . . . 0.0 110.864 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.439 ' HD2' ' HZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.09 123.59 4.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 111.414 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.541 ' HD3' ' HE2' ' A' ' 142' ' ' GLU . 3.5 tpt85 -152.34 138.16 18.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.683 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.631 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.3 OUTLIER -114.69 134.02 55.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.429 -179.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.402 HD13 ' C ' ' A' ' 135' ' ' GLU . 8.2 mt -91.11 122.67 33.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.524 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -115.89 123.49 48.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.33 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -167.05 142.03 4.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.823 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.472 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 9.2 p -82.02 109.86 16.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.29 -98.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.007 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -38.3 84.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 176.79 27.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.076 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.503 ' HG3' ' HD2' ' A' ' 93' ' ' PRO . 0.4 OUTLIER -158.82 130.67 4.09 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.478 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.593 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 47.6 Cg_endo -66.46 120.46 7.59 Favored 'Trans proline' 0 CA--C 1.516 -0.392 0 C-N-CA 123.381 2.721 . . . . 0.0 113.024 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.485 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 1.2 mmmt -101.31 123.21 45.05 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.794 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -95.73 109.0 21.36 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.631 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 t -108.41 108.82 26.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.977 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.604 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.14 125.29 40.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.575 ' HB3' HG13 ' A' ' 14' ' ' ILE . 32.7 m-85 -111.74 165.43 12.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.524 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 4.7 m-90 -152.68 138.56 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.292 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.462 ' CD2' ' N ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -75.84 124.92 28.11 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.524 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.565 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -131.49 143.71 50.61 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.357 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.594 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.0 tt0 -117.6 110.67 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.766 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.493 HG12 HG22 ' A' ' 70' ' ' ILE . 10.9 m -72.27 143.55 13.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.386 0.613 . . . . 0.0 111.589 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.518 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 3.8 mptp? -71.59 -12.53 61.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.885 -177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.534 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 6.5 t70 -133.35 127.61 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 111.931 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.619 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 59.7 t80 -62.54 -38.43 89.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -100.3 21.3 13.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.695 178.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -43.03 145.82 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.064 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.632 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -61.85 140.19 58.29 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.32 0.581 . . . . 0.0 110.621 -179.337 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.591 ' HA ' ' O ' ' A' ' 68' ' ' ALA . 28.6 mm -123.74 95.2 3.2 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.879 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.608 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.1 mtp85 -95.3 102.32 14.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.158 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.493 HD23 ' CG2' ' A' ' 110' ' ' ILE . 11.4 mt -90.65 144.49 25.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.11 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -89.09 -156.27 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 7.0 11.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.449 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -99.12 -29.86 12.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.9 m80 -120.61 157.36 29.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.823 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -120.16 -21.4 7.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.694 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -154.59 178.6 9.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.914 0.388 . . . . 0.0 111.507 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.52 ' CZ ' ' HB ' ' A' ' 110' ' ' ILE . 42.3 p90 -156.56 161.05 39.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.866 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.658 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -148.97 148.39 29.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.038 0.447 . . . . 0.0 111.383 179.588 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 81.2 m95 -105.96 106.9 17.62 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.458 HD21 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -135.3 169.71 17.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 0.0 111.666 -178.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.33 -151.83 3.93 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.763 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.54 -45.62 24.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.767 0.318 . . . . 0.0 111.351 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.47 -52.19 66.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.803 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.683 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.02 -46.7 67.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.558 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.522 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.54 -31.12 63.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.298 0.57 . . . . 0.0 109.763 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.4 m -82.57 -30.84 29.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.183 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.683 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.73 -43.55 88.7 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.725 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.629 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -77.73 -37.42 49.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.217 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.95 56.52 1.97 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.151 0.501 . . . . 0.0 110.085 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.57 -34.06 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.255 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -59.5 115.32 3.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.185 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -46.17 -44.92 16.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.381 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.402 ' C ' HD13 ' A' ' 85' ' ' LEU . 1.2 mp0 -49.31 -60.24 2.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.264 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.417 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -54.37 -40.23 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.921 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -53.41 -39.58 64.43 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.568 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.21 -44.39 30.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.378 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.477 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -52.19 -42.74 63.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.246 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.67 -29.52 40.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.015 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.92 -52.24 45.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.823 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.541 ' HE2' ' HD3' ' A' ' 83' ' ' ARG . 65.9 mt-10 -66.22 -28.91 69.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.424 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.1 -53.67 42.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.833 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -71.24 -30.23 66.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 0.0 110.106 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.82 -50.3 67.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.347 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -62.39 -52.08 65.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.738 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.508 HD13 ' CZ ' ' A' ' 16' ' ' PHE . 67.6 mt -55.03 -30.18 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.5 t -83.02 -8.43 59.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.594 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.299 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.114 0.483 . . . . 0.0 111.37 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -109.62 142.18 41.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.524 179.644 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.571 ' HB3' HG11 ' A' ' 50' ' ' VAL . 1.7 mtt180 -78.56 137.77 38.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.639 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -149.56 162.61 39.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.919 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.6 m -156.42 123.5 5.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.17 0.51 . . . . 0.0 111.54 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.479 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -113.47 178.0 18.29 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.555 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.414 HD21 HD13 ' A' ' 77' ' ' ILE . 1.1 mt -135.1 118.2 16.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.047 0.424 . . . . 0.0 111.801 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.49 HG12 ' HB3' ' A' ' 98' ' ' TYR . 11.2 mm -75.67 90.9 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.582 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 30.2 mt -84.97 136.65 22.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.711 -178.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.666 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.9 p90 -146.47 124.05 11.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.828 -178.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.508 ' HG3' ' CZ3' ' A' ' 121' ' ' TRP . 0.0 OUTLIER -80.47 113.21 18.49 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.008 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.424 -179.336 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.857 0.36 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.666 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 12.3 mt -102.88 147.71 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 111.485 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.591 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.4 mp0 -135.85 141.39 44.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.659 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.582 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 53.4 m-85 -103.37 149.71 24.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.927 0.394 . . . . 0.0 112.018 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.554 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 43.5 tp -84.02 136.64 33.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.466 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.3 mt -136.95 143.13 42.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.609 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -121.31 112.29 18.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.759 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.481 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 62.4 tt0 -60.68 134.22 56.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.315 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.626 179.528 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.452 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 15.0 p-80 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.515 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 45.6 m95 -115.69 112.61 22.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.959 0.409 . . . . 0.0 111.267 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -125.63 143.73 45.88 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.66 171.39 12.11 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.194 1.93 . . . . 0.0 111.97 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 25.2 Cg_endo -61.49 96.24 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.436 2.091 . . . . 0.0 112.109 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.456 ' HE3' HG12 ' A' ' 96' ' ' VAL . 7.3 mttt -86.63 170.64 11.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.49 ' HA3' ' HB1' ' A' ' 63' ' ' ALA . . . -166.58 128.58 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.696 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.69 109.91 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.571 HG11 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -79.42 137.02 22.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.097 0.475 . . . . 0.0 111.15 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 4.1 tt0 -95.12 151.48 38.82 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.277 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 7.4 Cg_endo -52.57 -31.02 47.45 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.71 2.273 . . . . 0.0 112.88 -179.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.556 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -91.2 -13.38 58.86 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.508 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -87.24 161.44 18.0 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.53 0.205 . . . . 0.0 110.684 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.874 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 31.1 t70 -78.29 160.89 27.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.364 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.446 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 15.5 m-20 -71.6 -62.21 1.5 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.253 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.558 ' HG ' HD13 ' A' ' 61' ' ' LEU . 24.8 tp -62.32 -40.44 96.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.299 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.874 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -50.32 -45.01 54.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.733 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.524 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 90.2 m -60.06 -41.81 93.16 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.23 -31.3 69.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.785 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.558 HD13 ' HG ' ' A' ' 57' ' ' LEU . 96.5 mt -73.5 -52.19 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.642 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -59.5 -44.09 93.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.57 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.49 ' HB1' ' HA3' ' A' ' 48' ' ' GLY . . . -58.77 -37.1 75.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.046 0.45 . . . . 0.0 110.045 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.482 HG22 ' CD1' ' A' ' 15' ' ' ILE . 34.7 m -60.32 -54.02 50.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.549 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 10.7 pt20 -73.23 -21.7 60.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.915 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -79.32 -41.69 27.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.219 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 17.5 mp0 -106.1 2.58 27.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.722 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -144.59 -8.99 0.64 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.579 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 72.51 1.02 51.04 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.934 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.549 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 3.9 mt -103.7 122.23 56.12 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.7 pt-20 -107.24 168.55 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.441 -179.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.563 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -47.18 -36.13 8.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.507 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.62 78.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.109 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.452 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 0.2 OUTLIER -91.52 -6.6 52.25 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.704 0.288 . . . . 0.0 111.06 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.609 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -135.9 -176.2 4.23 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.86 0.362 . . . . 0.0 110.24 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 94.7 m -124.63 103.24 8.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.726 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.504 HD12 ' HB1' ' A' ' 101' ' ' ALA . 14.2 mm -77.63 109.79 12.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.905 0.383 . . . . 0.0 111.569 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.603 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -72.42 138.3 21.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.701 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -94.27 148.84 21.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.468 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.87 -23.09 34.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.736 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.468 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 34.4 t80 -100.71 125.25 47.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.38 . . . . 0.0 111.075 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.502 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.48 126.09 5.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.176 0.512 . . . . 0.0 111.273 179.693 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -153.81 137.44 16.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.202 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.726 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -118.08 134.6 54.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 0.0 111.35 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.409 HD11 ' CE2' ' A' ' 98' ' ' TYR . 8.1 mt -101.62 117.82 35.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.481 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.447 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.24 126.51 53.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.144 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -166.93 140.23 3.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.48 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 8.6 p -80.41 108.82 14.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.557 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.62 -95.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.587 -178.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.493 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -69.98 -39.15 76.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.72 0.295 . . . . 0.0 110.875 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.493 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 6.2 t-20 176.41 29.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.853 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.568 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.65 123.99 2.51 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.737 179.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.618 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 59.6 Cg_endo -73.43 117.63 5.16 Favored 'Trans proline' 0 CA--C 1.515 -0.436 0 C-N-CA 123.025 2.483 . . . . 0.0 112.832 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.468 ' HG2' HD12 ' A' ' 8' ' ' LEU . 2.1 mmmt -103.0 121.73 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.349 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.2 m -88.74 113.61 24.49 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.726 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.9 t -112.44 109.41 28.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.222 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.634 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -84.92 130.14 36.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.499 ' CE2' HG11 ' A' ' 96' ' ' VAL . 37.4 m-85 -115.62 137.7 51.81 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.502 ' CE2' ' HG3' ' A' ' 82' ' ' LYS . 1.8 m-90 -125.92 143.83 50.92 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.113 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 6.2 mt -75.5 123.84 26.15 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.514 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.504 ' HB1' HD12 ' A' ' 77' ' ' ILE . . . -131.98 144.16 50.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.423 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.7 tt0 -123.64 112.63 17.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.601 0.238 . . . . 0.0 111.111 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.609 HG12 HD23 ' A' ' 75' ' ' LEU . 3.4 m -72.81 112.77 9.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.751 0.786 . . . . 0.0 110.387 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -8.78 14.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.517 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.823 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 6.1 m-20 -112.43 107.04 15.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.942 0.401 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.405 ' CD1' ' HD2' ' A' ' 17' ' ' ARG . 2.7 t80 -55.47 -39.78 70.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -101.09 26.18 7.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.69 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.823 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.5 p -47.9 146.47 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.347 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 5.9 pm0 -68.68 143.09 54.86 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.118 0.485 . . . . 0.0 110.542 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.592 HG13 ' CE2' ' A' ' 119' ' ' TYR . 42.2 mm -120.97 97.55 5.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.511 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.579 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 19.5 mtp180 -101.84 99.92 10.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.435 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.429 HD22 ' CG2' ' A' ' 110' ' ' ILE . 3.1 mt -92.06 -172.6 3.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.822 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.7 t -125.97 -172.57 2.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.811 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -66.58 -25.01 66.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.329 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.75 -12.53 60.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.29 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -124.26 105.94 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.792 0.33 . . . . 0.0 110.764 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.52 -17.0 60.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.876 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.24 -179.57 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.126 0.489 . . . . 0.0 111.703 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.592 ' CE2' HG13 ' A' ' 110' ' ' ILE . 42.3 p90 -145.65 171.89 14.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.717 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.454 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 64.9 mtt180 -157.94 153.25 25.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.244 0.545 . . . . 0.0 111.675 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.554 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 90.6 m95 -118.03 107.14 13.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.367 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.427 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -136.63 173.59 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.045 0.45 . . . . 0.0 111.684 -178.555 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -79.94 -153.24 8.25 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.798 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.46 -41.16 40.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.0 pt-20 -61.05 -51.93 67.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.749 0.309 . . . . 0.0 111.413 -179.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.688 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.36 -48.72 60.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.904 0.383 . . . . 0.0 110.227 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.466 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.94 -27.25 29.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.23 -32.89 26.24 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.952 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.688 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.76 -46.99 82.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.651 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.4 OUTLIER -78.3 -37.19 45.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.512 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.457 ' HB3' ' CB ' ' A' ' 136' ' ' MET . . . -75.36 52.22 0.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.069 0.461 . . . . 0.0 110.813 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.76 -32.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.62 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -63.4 120.53 11.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.617 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.61 -49.41 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.006 0.431 . . . . 0.0 111.175 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -47.25 -53.24 13.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.673 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.457 ' CB ' ' HB3' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -60.03 -43.0 95.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.186 -179.243 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.5 OUTLIER -53.29 -36.57 61.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.01 -42.43 32.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.255 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.881 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.2 mt -78.39 -27.52 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.984 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.538 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.19 -51.85 33.8 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.854 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.21 -30.04 67.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.393 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.57 -49.52 72.84 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.823 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.438 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 6.4 t-160 -76.25 -36.32 58.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.053 0.454 . . . . 0.0 110.273 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -61.02 -52.72 63.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.533 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.94 -50.56 72.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.016 0.436 . . . . 0.0 111.191 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.632 HD13 ' CE1' ' A' ' 16' ' ' PHE . 94.0 mt -56.88 -31.71 65.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.678 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.16 -4.18 54.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.797 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.795 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.649 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 121.037 0.446 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.603 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -109.4 139.9 43.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.043 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.453 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -83.92 123.71 30.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.993 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.45 163.52 30.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 m -157.75 124.04 4.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.544 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.53 170.13 13.27 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.488 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 117.91 26.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.452 HG13 ' HB3' ' A' ' 98' ' ' TYR . 78.5 mt -86.77 91.74 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 52.7 mt -79.94 146.31 7.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.622 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.652 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 51.4 p90 -151.33 122.27 7.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.439 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.11 112.24 18.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.548 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.701 0.286 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.652 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.9 mt -129.02 140.43 49.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.453 . . . . 0.0 111.99 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -135.24 126.93 29.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.001 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.0 m-85 -89.7 150.46 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 44.0 tp -85.88 138.53 31.97 Favored 'General case' 0 CA--C 1.523 -0.059 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.866 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.5 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.5 mt -139.13 132.77 30.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.402 HD12 ' HG3' ' A' ' 46' ' ' PRO . 17.0 mt -108.92 100.2 9.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.93 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.457 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 41.1 tt0 -55.08 133.95 49.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.922 179.02 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 . . . . . 0 N--CA 1.456 -0.139 0 CA-C-O 120.944 0.402 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.533 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 5.9 m95 -101.63 128.5 47.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.49 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 139.4 27.19 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.265 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.87 164.34 6.22 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.244 1.962 . . . . 0.0 111.975 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.501 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 29.0 Cg_exo -60.34 83.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.528 0.186 0 C-N-CA 122.669 2.246 . . . . 0.0 112.314 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.544 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.48 153.09 19.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.038 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.4 -154.83 6.45 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.088 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -125.36 109.33 12.64 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.547 0.213 . . . . 0.0 110.912 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.456 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.3 p -83.21 132.59 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.554 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 2.6 tt0 -95.07 152.15 39.3 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.417 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.554 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.9 Cg_endo -49.26 -31.29 21.87 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.945 2.43 . . . . 0.0 112.831 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.532 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -94.97 -10.66 57.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.304 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -88.6 158.71 18.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.512 0.196 . . . . 0.0 110.589 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.848 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.2 t0 -76.78 160.34 29.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.012 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.92 -61.5 1.83 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.221 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.457 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.6 tp -61.39 -42.14 98.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.747 0.308 . . . . 0.0 111.076 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.848 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.26 -46.7 55.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.373 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.456 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 89.2 m -55.66 -42.32 74.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.33 -32.7 68.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.059 178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 96.5 mt -71.19 -52.97 16.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.603 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.41 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 mtt180 -58.09 -39.28 78.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.748 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.6 -30.39 71.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.114 0.483 . . . . 0.0 109.945 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.501 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 18.5 m -65.04 -50.94 64.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.64 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.56 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.5 pp0? -76.05 -24.85 55.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.933 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -79.04 -37.56 38.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.902 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.406 ' O ' HD22 ' A' ' 112' ' ' LEU . 12.9 mt-10 -104.27 -8.81 19.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.911 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -138.42 -3.25 1.73 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.79 0.24 32.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.619 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.56 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.3 mt -103.95 123.99 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.81 167.12 10.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.502 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -48.53 -27.62 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.251 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.29 -21.03 76.44 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.227 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.502 ' HG2' HG22 ' A' ' 70' ' ' ILE . 1.2 tp60 -98.06 -9.39 26.03 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.542 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -126.03 -171.23 2.34 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.097 0.475 . . . . 0.0 110.514 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 83.9 m -133.85 100.67 4.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.385 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.404 HD11 HD21 ' A' ' 61' ' ' LEU . 8.1 mm -74.14 118.38 19.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.467 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -80.74 132.83 30.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -91.04 148.57 22.3 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.122 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.1 -26.8 19.44 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.588 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.471 ' CD1' HD22 ' A' ' 100' ' ' LEU . 11.6 t80 -103.49 124.26 48.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.0 111.038 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.461 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 127.93 6.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.196 179.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.89 142.68 17.74 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.169 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.647 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 4.2 pm0 -120.87 141.4 50.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.105 0.479 . . . . 0.0 111.816 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.4 mt -101.36 118.73 37.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.078 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -111.42 124.44 52.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.144 0.497 . . . . 0.0 111.038 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.6 p90 -167.08 145.86 5.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.823 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.623 ' O ' HG13 ' A' ' 88' ' ' VAL . 11.4 p -85.62 111.86 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.764 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.43 -106.34 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.278 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -39.61 93.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.858 0.361 . . . . 0.0 110.555 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.4 t30 178.25 30.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.968 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.603 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -156.45 125.4 3.03 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.649 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 55.9 Cg_endo -70.3 116.49 4.64 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 123.206 2.604 . . . . 0.0 112.825 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.479 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -99.95 128.39 46.05 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.699 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.6 m -95.59 104.95 16.89 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 177.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.647 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 36.2 t -104.05 108.43 24.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.966 -178.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.625 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.38 136.62 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.452 ' HB3' HG13 ' A' ' 14' ' ' ILE . 37.2 m-85 -123.49 129.86 51.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.461 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 3.8 m-90 -115.03 148.88 38.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.026 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.471 HD22 ' CD1' ' A' ' 81' ' ' PHE . 6.6 mt -83.29 127.47 33.68 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -133.97 144.6 48.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.627 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -123.31 116.74 23.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.793 0.33 . . . . 0.0 111.396 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.635 ' O ' HG23 ' A' ' 103' ' ' VAL . 4.8 m -76.93 121.04 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 121.447 0.642 . . . . 0.0 110.833 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -22.24 66.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.522 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.745 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 4.6 m-20 -104.94 119.83 39.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.987 0.422 . . . . 0.0 111.712 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -43.88 95.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.168 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -96.22 21.26 9.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.079 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.745 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -42.26 145.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.367 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.661 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -62.03 141.2 58.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.318 0.58 . . . . 0.0 111.3 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.608 ' CG2' HD21 ' A' ' 112' ' ' LEU . 35.4 mm -123.99 100.48 7.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.661 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -99.67 101.61 12.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.416 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.608 HD21 ' CG2' ' A' ' 110' ' ' ILE . 17.3 mt -92.75 163.87 13.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.43 -168.9 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -64.46 -18.53 64.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.347 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.93 -18.25 35.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.688 0.28 . . . . 0.0 111.17 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -120.02 136.78 54.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -109.74 -19.17 13.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.533 -179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.52 166.25 16.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.869 0.366 . . . . 0.0 111.198 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CD2' ' CG2' ' A' ' 110' ' ' ILE . 43.0 p90 -139.74 173.59 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.841 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.468 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 26.4 mtt-85 -160.68 158.33 28.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 0.0 111.486 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.405 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 86.3 m95 -122.09 107.4 12.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.28 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.43 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.67 172.7 12.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.065 0.46 . . . . 0.0 111.833 -178.198 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.0 -151.47 6.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.233 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.9 tp -77.3 -46.05 24.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.574 0.226 . . . . 0.0 111.539 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -58.18 -51.43 69.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.496 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.567 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -67.55 -54.1 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.069 0.461 . . . . 0.0 110.242 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.5 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -49.87 -31.11 11.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 0.0 110.157 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.7 m -83.86 -30.79 26.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.736 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.567 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -63.87 -43.4 96.18 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.788 -179.861 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.533 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -77.66 -42.55 34.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.184 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.79 54.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 0.0 110.165 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.67 -33.9 0.09 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.302 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -59.59 120.54 9.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.676 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.38 -54.71 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.246 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 21.4 mp0 -41.67 -54.74 3.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.143 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.529 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -63.01 -44.64 95.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.206 -179.203 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.03 -42.58 49.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.384 . . . . 0.0 109.994 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.468 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.45 -45.04 73.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.76 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -53.16 -42.62 66.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.81 -29.2 32.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.319 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.71 -51.62 66.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.904 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.84 -29.24 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.483 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.08 72.3 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.215 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.423 ' CD2' HD11 ' A' ' 29' ' ' ILE . 59.4 t-80 -80.41 -29.48 37.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.63 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -67.01 -52.63 40.18 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.243 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -63.3 -49.29 74.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.55 HD11 ' CE1' ' A' ' 16' ' ' PHE . 78.7 mt -57.26 -32.93 67.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.838 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -70.32 -16.64 63.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.8 0.333 . . . . 0.0 110.946 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.232 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.513 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.596 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 121.065 0.46 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.485 ' CD1' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -106.69 125.83 51.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.539 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' CD2' ' A' ' 49' ' ' HIS . 0.3 OUTLIER -79.09 115.58 18.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.099 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' ' O ' ' A' ' 95' ' ' THR . . . -126.78 160.65 30.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 87.4 m -152.01 123.49 7.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.696 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.577 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -114.69 177.59 17.56 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.016 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.453 HD11 ' CD1' ' A' ' 77' ' ' ILE . 0.7 OUTLIER -127.55 117.42 22.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.704 0.288 . . . . 0.0 111.44 -179.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.61 HG13 ' HB3' ' A' ' 98' ' ' TYR . 73.4 mt -83.95 91.37 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 17.3 mt -79.23 145.22 9.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.238 -178.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.597 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.8 p90 -148.37 121.95 9.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.849 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 121' ' ' TRP . 3.9 ttp180 -85.95 112.75 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.001 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 121.071 0.463 . . . . 0.0 111.439 -179.492 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.768 0.318 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.597 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.5 mt -112.31 141.8 26.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 0.0 112.02 -179.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.729 ' HE2' ' HH ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -128.18 136.08 50.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.098 179.593 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.559 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 50.5 m-85 -95.66 154.37 17.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.53 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 56.2 tp -86.93 134.41 33.51 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.496 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.2 mt -135.94 140.23 43.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.3 mt -115.64 127.42 55.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.454 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -65.93 157.47 30.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.174 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.721 -179.666 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' CD2' ' A' ' 42' ' ' HIS . 5.8 p-80 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.912 0.386 . . . . 0.0 110.598 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.488 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 41.7 m95 -101.68 129.97 47.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.3 p -149.06 143.97 17.57 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -56.16 159.61 12.25 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.313 2.009 . . . . 0.0 112.034 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.548 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 42.9 Cg_exo -57.83 88.9 0.05 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.684 2.256 . . . . 0.0 112.321 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.1 OUTLIER -104.64 156.21 18.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 111.319 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.45 -152.85 6.74 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.451 ' CD2' ' O ' ' A' ' 9' ' ' ARG . 9.8 t-80 -135.54 106.08 6.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.423 ' HA ' ' OG1' ' A' ' 59' ' ' THR . 1.5 p -78.64 129.45 37.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 121.146 0.498 . . . . 0.0 111.472 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 2.2 tt0 -91.21 153.54 44.64 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.148 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.556 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.8 Cg_endo -44.0 -38.46 10.35 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.108 2.538 . . . . 0.0 113.004 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.515 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.93 -4.16 63.49 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.982 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -91.32 154.6 19.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.723 0.261 . . . . 0.0 110.856 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.887 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 17.3 t70 -73.03 158.45 35.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.995 0.426 . . . . 0.0 110.104 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -74.58 -65.38 0.87 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.809 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.511 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 20.2 tp -59.71 -37.65 79.45 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.704 0.287 . . . . 0.0 110.754 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.887 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.1 mt-10 -50.27 -50.03 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.379 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 50' ' ' VAL . 20.7 m -54.7 -42.5 71.55 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.52 -32.33 69.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.887 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 95.0 mt -71.04 -52.31 20.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.312 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -61.77 -42.81 99.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.464 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.06 71.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.236 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 97.6 m -63.73 -49.28 73.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.36 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.549 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 12.3 pt20 -80.32 -23.26 40.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.716 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -79.0 -31.8 44.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.189 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -111.63 -14.6 13.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.625 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -130.69 -5.35 4.1 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.461 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.95 1.83 49.59 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.026 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.549 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.9 mt -104.11 125.33 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 CA-C-O 120.918 0.389 . . . . 0.0 110.619 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.1 pt-20 -105.69 168.38 9.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.522 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.47 -36.36 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.762 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.83 -22.44 76.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.99 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.447 ' HB3' HG22 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -93.21 -5.08 50.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.607 0.241 . . . . 0.0 111.191 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.21 -166.16 1.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.784 0.326 . . . . 0.0 110.376 178.764 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 90.3 m -139.33 97.85 3.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.513 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.453 ' CD1' HD11 ' A' ' 13' ' ' LEU . 11.1 mm -71.42 106.33 2.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.212 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.451 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.37 133.35 32.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.596 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.53 151.14 20.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.251 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -21.51 40.36 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.884 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.516 ' CD1' HD22 ' A' ' 100' ' ' LEU . 19.9 t80 -105.36 127.78 53.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.791 0.329 . . . . 0.0 111.496 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 6.7 ttpt -158.52 128.06 5.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.525 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.79 147.68 25.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.722 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.633 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.8 OUTLIER -128.27 138.04 52.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.189 0.518 . . . . 0.0 111.951 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 135' ' ' GLU . 6.6 mt -99.45 124.75 44.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.122 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -114.21 124.76 52.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.32 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -167.49 146.87 5.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.097 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.483 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 11.0 p -89.55 107.68 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.721 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -74.91 -101.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.563 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.47 -49.43 77.59 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-O 120.91 0.386 . . . . 0.0 110.579 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.07 27.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.187 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.483 ' N ' ' CG2' ' A' ' 88' ' ' VAL . 0.0 OUTLIER -154.59 131.43 5.94 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 120.931 0.396 . . . . 0.0 110.635 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.596 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 57.9 Cg_endo -69.33 120.0 6.9 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.56 2.84 . . . . 0.0 112.869 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.432 ' HG2' HD11 ' A' ' 8' ' ' LEU . 18.3 mtpp -105.05 128.29 53.26 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.098 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.403 ' O ' ' O ' ' A' ' 10' ' ' ALA . 41.4 m -95.5 109.12 21.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.633 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.5 t -106.82 108.51 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.592 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.73 128.27 39.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.61 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.8 m-85 -116.63 131.45 56.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -177.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.445 ' CD2' HD11 ' A' ' 57' ' ' LEU . 3.3 m-90 -116.36 155.86 27.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.248 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.516 HD22 ' CD1' ' A' ' 81' ' ' PHE . 2.6 mt -89.83 124.42 34.65 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.513 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -133.08 137.1 46.26 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.75 0.309 . . . . 0.0 110.812 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.521 ' HB2' ' CE1' ' A' ' 16' ' ' PHE . 13.8 tt0 -113.4 114.53 26.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.572 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.501 HG13 HD23 ' A' ' 75' ' ' LEU . 8.3 m -72.75 101.22 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 121.427 0.632 . . . . 0.0 110.311 179.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -9.64 0.85 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.417 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.835 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 9.8 m-20 -108.41 100.87 10.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.933 0.396 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.729 ' HH ' ' HE2' ' A' ' 30' ' ' GLU . 0.1 OUTLIER -52.27 -38.81 59.29 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.992 0.425 . . . . 0.0 110.574 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.58 26.9 5.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.708 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.835 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.7 p -51.5 144.48 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.293 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -70.71 143.88 51.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.999 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.598 HG13 ' CE2' ' A' ' 119' ' ' TYR . 35.9 mm -121.7 98.97 6.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.461 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.04 103.14 15.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.85 -179.307 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 14.5 mt -91.81 173.18 8.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.03 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.9 p -117.15 -172.22 2.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -66.82 -12.49 59.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.668 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -90.7 -23.37 20.74 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.599 0.237 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.1 m80 -113.93 118.92 35.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.933 0.397 . . . . 0.0 110.878 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -85.35 -22.32 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.382 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.33 -177.14 3.93 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.927 0.394 . . . . 0.0 111.497 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.598 ' CE2' HG13 ' A' ' 110' ' ' ILE . 44.5 p90 -148.96 174.4 12.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.441 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 7.3 mtt180 -157.07 149.54 23.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.267 0.556 . . . . 0.0 111.851 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.521 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 94.6 m95 -112.78 106.83 15.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.325 178.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.29 167.61 21.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.1 0.476 . . . . 0.0 111.677 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.8 -165.55 28.94 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.912 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.4 tp -64.54 -43.29 94.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.99 -53.8 54.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.51 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.699 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.48 -48.28 56.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.937 0.399 . . . . 0.0 110.1 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.429 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -52.81 -26.93 15.99 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.8 OUTLIER -82.97 -38.58 22.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.804 178.571 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.699 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -58.33 -45.2 88.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.844 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.623 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -78.71 -38.42 39.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.289 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.23 50.19 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.713 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.433 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.43 -32.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.259 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -59.9 119.69 8.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.773 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -46.48 -50.16 17.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.569 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.438 ' HB3' ' CD1' ' A' ' 85' ' ' LEU . 35.6 mp0 -48.25 -54.76 12.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.139 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.17 -44.0 97.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.752 0.31 . . . . 0.0 110.934 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.12 -39.28 27.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.158 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.7 -47.05 50.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.599 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.492 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -52.59 -46.72 67.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.322 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.45 -27.62 58.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.115 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.527 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.95 -51.8 55.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.209 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.454 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -73.79 -29.68 62.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.481 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.54 -50.32 66.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.757 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -70.25 -37.61 74.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.097 0.475 . . . . 0.0 110.077 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 45.9 tp60 -59.77 -52.49 65.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.245 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -55.08 -55.41 31.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.926 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.58 HD11 ' CE2' ' A' ' 16' ' ' PHE . 87.6 mt -58.56 -41.22 85.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.08 -12.96 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.691 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.14 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 121.098 0.475 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.66 137.26 46.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.751 179.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.48 ' HB3' HG12 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -81.84 129.72 34.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.828 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -142.09 164.07 31.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.258 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 28.1 m -153.49 123.67 7.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.407 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.51 173.93 15.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.861 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.89 117.89 22.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.959 0.38 . . . . 0.0 111.336 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.523 HG13 ' HB3' ' A' ' 98' ' ' TYR . 65.8 mt -84.73 91.7 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 52.4 mt -81.99 145.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.33 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.642 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 42.9 p90 -148.98 121.41 8.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.776 -179.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.59 113.81 21.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.03 0.443 . . . . 0.0 110.688 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.025 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.115 0 CA-C-O 120.962 0.411 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.642 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.7 mt -87.29 154.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.569 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.461 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.3 mt-10 -135.63 125.06 24.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.508 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 52.0 m-85 -91.15 145.28 24.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.55 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.475 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.4 tp -85.09 138.93 32.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.05 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.4 mt -139.11 144.21 38.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.433 ' HB3' ' CG ' ' A' ' 116' ' ' HIS . 24.3 mt -122.69 107.23 11.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.752 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.3 tt0 -64.45 136.75 57.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.002 0.429 . . . . 0.0 111.314 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.819 179.519 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.458 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 15.9 p-80 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.903 0.383 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.518 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 30.1 m95 -113.15 142.86 45.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.248 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.86 138.54 8.56 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 170.41 2.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.547 2.164 . . . . 0.0 112.055 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.414 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 31.8 Cg_exo -58.81 99.79 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.58 2.186 . . . . 0.0 112.517 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.12 148.94 21.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.611 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -131.16 178.76 17.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.839 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -121.17 90.69 3.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.663 0.268 . . . . 0.0 110.728 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.487 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.3 p -71.26 132.99 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.007 0.432 . . . . 0.0 111.04 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.549 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.4 tt0 -96.8 151.72 38.01 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.854 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.549 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 2.6 Cg_endo -47.84 -30.32 13.06 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.864 2.376 . . . . 0.0 112.704 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.508 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -96.74 -9.7 56.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.525 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -87.65 162.17 17.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.492 0.187 . . . . 0.0 110.632 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.841 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 11.8 t70 -78.45 161.35 27.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.997 0.427 . . . . 0.0 110.346 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -74.24 -64.7 0.96 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.415 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.454 ' HG ' HD12 ' A' ' 61' ' ' LEU . 10.6 tp -61.52 -40.14 93.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.226 -179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.92 -50.08 58.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.61 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.487 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 99.5 m -55.34 -39.19 69.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.861 0.362 . . . . 0.0 110.144 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.86 67.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.685 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.454 HD12 ' HG ' ' A' ' 57' ' ' LEU . 82.9 mt -64.48 -52.91 55.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.518 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -43.78 97.42 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.47 -33.7 71.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.019 0.438 . . . . 0.0 110.156 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.43 HG23 ' CD1' ' A' ' 15' ' ' ILE . 23.8 m -60.53 -51.02 71.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.276 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.522 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 8.2 pt20 -77.76 -25.11 48.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.048 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -76.52 -32.66 58.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.08 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -114.92 -0.18 13.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.868 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -144.04 -8.54 0.7 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.465 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 74.12 -1.32 49.2 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.183 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.522 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 3.0 mt -103.06 126.1 57.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 117.034 0.417 . . . . 0.0 111.231 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.441 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.3 pt-20 -109.92 169.35 8.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.0 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.509 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.5 -36.81 24.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.356 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.53 -15.63 68.62 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.394 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.434 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 1.5 tp-100 -101.48 -11.85 19.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.638 0.256 . . . . 0.0 111.299 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.18 -171.5 2.43 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 121.021 0.438 . . . . 0.0 110.512 179.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 88.2 m -132.6 99.77 4.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.664 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.0 mm -71.63 120.52 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.191 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.1 mp -80.66 136.51 23.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -94.82 150.62 20.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.227 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.42 -18.5 55.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.867 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.457 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 14.3 t80 -109.74 128.06 55.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.874 0.368 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 130.93 7.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -153.57 140.7 19.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.56 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.2 pm0 -119.46 124.23 46.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.786 0.327 . . . . 0.0 111.08 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.3 mt -91.15 125.31 35.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.522 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -118.03 121.42 40.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.487 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.41 ' CD2' ' OE2' ' A' ' 135' ' ' GLU . 22.9 p90 -167.11 142.66 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.81 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.457 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 7.8 p -77.63 112.56 15.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.398 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.53 -98.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.528 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -43.23 98.26 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.915 0.388 . . . . 0.0 110.637 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.08 31.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.563 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -163.42 129.54 2.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.344 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.574 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 48.9 Cg_endo -66.81 119.41 6.43 Favored 'Trans proline' 0 CA--C 1.514 -0.523 0 C-N-CA 123.328 2.686 . . . . 0.0 112.912 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.465 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 1.2 mmmt -103.5 120.75 41.46 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.974 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.9 m -85.59 106.43 16.89 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 t -105.11 108.58 25.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.102 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.536 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.49 129.03 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.523 ' HB3' HG13 ' A' ' 14' ' ' ILE . 44.5 m-85 -117.61 158.34 24.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.431 0.634 . . . . 0.0 112.682 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.439 ' CD2' HD12 ' A' ' 57' ' ' LEU . 8.4 m-90 -143.73 150.61 38.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.889 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.457 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -86.22 121.33 28.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -129.81 147.19 51.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.122 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.9 OUTLIER -121.81 116.17 23.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.205 -179.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.502 HG11 ' CG2' ' A' ' 15' ' ' ILE . 10.0 m -76.02 116.27 18.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.302 0.572 . . . . 0.0 110.989 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -24.98 63.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.725 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.768 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 22.1 m-20 -99.29 112.76 24.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.142 0.496 . . . . 0.0 111.418 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -57.46 -45.64 84.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.181 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.26 25.19 5.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.861 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.768 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 3.2 p -43.92 145.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.004 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -66.35 142.1 57.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.294 0.568 . . . . 0.0 110.998 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.537 HG13 ' CE2' ' A' ' 119' ' ' TYR . 36.6 mm -121.75 98.15 5.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.465 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.9 OUTLIER -101.16 101.83 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.999 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.418 HD22 HG23 ' A' ' 110' ' ' ILE . 12.8 mt -87.9 173.15 9.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.159 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.3 -167.07 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.989 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -68.68 -14.07 62.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.403 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.03 -17.87 31.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.692 0.282 . . . . 0.0 111.427 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.433 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 90.2 m-70 -130.17 129.63 43.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.785 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -21.26 18.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.701 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.78 -177.66 6.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.989 0.424 . . . . 0.0 111.643 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.537 ' CE2' HG13 ' A' ' 110' ' ' ILE . 43.1 p90 -156.46 169.19 25.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.468 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.45 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -160.86 154.64 22.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 111.569 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.415 ' CH2' HG23 ' A' ' 103' ' ' VAL . 93.2 m95 -111.12 107.44 16.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.632 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -134.12 168.35 19.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.378 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.16 -152.53 5.91 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.946 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.1 tp -77.11 -45.8 25.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.853 0.327 . . . . 0.0 111.334 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -58.04 -48.97 78.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.593 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.749 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.46 -48.98 36.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.881 0.372 . . . . 0.0 110.514 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.434 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.15 -30.11 35.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.326 0.584 . . . . 0.0 109.772 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.65 -32.79 25.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.408 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.749 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.0 -42.13 97.27 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.461 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.604 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -78.28 -41.67 33.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.359 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.401 ' HB3' ' HB2' ' A' ' 136' ' ' MET . . . -76.7 55.97 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.726 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.474 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.32 -33.14 0.09 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.478 ' HD2' ' HE2' ' A' ' 135' ' ' GLU . 21.1 m-85 -57.69 113.36 1.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.59 -41.2 14.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.392 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.478 ' HE2' ' HD2' ' A' ' 133' ' ' PHE . 1.6 mp0 -55.01 -51.53 65.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.185 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.447 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.85 -44.79 95.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.67 -39.51 36.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.965 0.412 . . . . 0.0 109.915 179.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.555 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.43 -45.55 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.543 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -51.77 -44.32 63.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.173 0.511 . . . . 0.0 110.215 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.04 -28.18 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.224 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.555 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.04 -51.99 53.14 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.81 -29.98 68.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.21 -57.02 21.26 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.807 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 2.7 t-160 -67.87 -33.1 74.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.762 0.315 . . . . 0.0 110.262 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -63.02 -52.55 62.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.33 -47.68 78.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.458 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.531 HD13 ' CE2' ' A' ' 16' ' ' PHE . 45.1 mt -57.31 -28.72 63.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.443 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -80.38 -14.16 58.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.931 0.396 . . . . 0.0 110.425 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 N--CA 1.454 -0.228 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.283 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 121.299 0.571 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.593 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -105.66 140.18 39.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.453 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.82 131.69 35.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.132 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -144.26 165.09 28.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 18.7 m -155.88 123.59 5.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.183 0.516 . . . . 0.0 111.418 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.55 175.45 16.15 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.586 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.445 ' HA ' HD21 ' A' ' 13' ' ' LEU . 1.0 OUTLIER -130.92 117.53 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.153 0.476 . . . . 0.0 111.518 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 98' ' ' TYR . 44.9 mt -84.33 91.27 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 21.2 mt -79.01 146.11 8.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.856 -1.065 . . . . 0.0 111.686 -177.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.741 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.2 p90 -152.48 122.9 7.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.568 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.77 113.76 19.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.647 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.401 ' CB ' ' HG3' ' A' ' 102' ' ' GLU . 22.8 ttm180 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.313 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 120.7 0.286 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.741 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.6 mt -102.47 151.03 6.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.116 0.484 . . . . 0.0 111.943 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.545 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 2.3 mt-10 -137.76 129.57 28.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.821 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.2 m-85 -91.91 148.86 21.89 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.544 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 46.4 tp -85.15 137.08 33.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.925 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.463 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.6 mt -137.13 138.31 40.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.368 . . . . 0.0 111.057 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 116' ' ' HIS . 11.1 mt -118.21 119.08 33.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.642 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.462 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 40.9 tt0 -82.48 133.84 35.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.538 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.382 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.923 0.392 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.512 ' CG ' ' HB3' ' A' ' 130' ' ' LEU . 78.1 m95 -104.32 131.8 51.25 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.936 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.417 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -158.07 156.31 27.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.959 -179.791 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.8 176.89 9.42 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.378 2.052 . . . . 0.0 111.984 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.446 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 39.2 Cg_exo -60.58 114.58 2.2 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.535 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -103.61 142.35 34.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.047 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -132.62 172.52 21.23 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.235 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -120.9 95.13 4.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.814 0.34 . . . . 0.0 111.122 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 1.9 p -70.1 132.25 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.618 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.5 tt0 -96.98 152.4 38.32 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.85 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.549 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.1 Cg_endo -45.12 -33.99 8.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.018 2.479 . . . . 0.0 112.866 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.618 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.37 -10.42 59.41 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.594 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -86.45 168.0 14.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.608 0.242 . . . . 0.0 110.795 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.841 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.5 t70 -85.95 161.37 19.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 110.698 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -73.67 -65.67 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.867 -179.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.498 HD11 ' CD2' ' A' ' 99' ' ' TRP . 22.2 tp -62.28 -38.94 91.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.307 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.88 -50.17 57.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.468 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.433 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 61.4 m -54.64 -38.98 67.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.07 -31.11 62.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.043 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.441 HD11 ' HG ' ' A' ' 57' ' ' LEU . 82.5 mt -74.18 -53.04 10.67 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.882 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -60.36 -42.96 96.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.542 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -33.82 71.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 0.0 110.038 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.484 HG21 ' CD1' ' A' ' 15' ' ' ILE . 32.7 m -62.45 -54.24 43.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.586 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -71.56 -21.16 61.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.165 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.61 -42.64 24.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.743 0.306 . . . . 0.0 111.017 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -105.49 6.16 32.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.637 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -148.61 -8.59 0.37 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.434 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 70.88 0.92 36.44 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.233 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.561 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -104.23 121.43 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-O 120.968 0.414 . . . . 0.0 110.778 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.3 pm0 -104.89 169.35 8.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.48 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -52.54 -26.78 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 110.705 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.416 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -75.05 -11.1 84.16 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.108 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.444 ' CG ' HG22 ' A' ' 70' ' ' ILE . 70.0 tp60 -110.58 -16.07 13.73 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.455 0.169 . . . . 0.0 111.102 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.487 ' CD2' HG23 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -119.55 -170.17 1.89 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.935 0.397 . . . . 0.0 110.512 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 60.4 m -136.36 102.13 4.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.172 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.553 HD12 ' HB2' ' A' ' 101' ' ' ALA . 9.7 mm -74.11 124.31 31.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.286 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.49 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.95 136.04 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.281 0.562 . . . . 0.0 111.273 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -96.31 147.83 23.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.61 -29.59 11.17 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.478 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 20.0 t80 -102.95 129.79 49.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.76 0.314 . . . . 0.0 110.886 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.56 129.05 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.413 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -149.15 136.01 19.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.133 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.674 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 3.0 pm0 -122.31 127.79 50.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.952 0.406 . . . . 0.0 111.24 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.599 HD13 ' HE2' ' A' ' 98' ' ' TYR . 6.1 mt -91.84 120.66 32.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.499 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -109.84 124.47 51.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.597 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.5 p90 -166.83 144.3 4.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.814 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.482 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 9.7 p -85.15 108.88 17.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.909 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.94 -97.93 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.158 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -62.28 -50.09 73.06 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.861 0.363 . . . . 0.0 110.682 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -175.1 29.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.244 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.593 ' HB3' HD13 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -161.69 130.45 3.03 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.515 179.47 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.574 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 51.3 Cg_endo -68.32 117.8 5.2 Favored 'Trans proline' 0 CA--C 1.518 -0.313 0 C-N-CA 123.204 2.603 . . . . 0.0 112.789 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.466 ' HG2' HD11 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -100.98 117.35 34.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.86 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.7 m -80.75 112.54 18.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.6 t -110.47 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.656 -178.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.612 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.0 130.24 36.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.599 ' HE2' HD13 ' A' ' 85' ' ' LEU . 9.5 m-85 -115.52 128.81 56.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.025 0.441 . . . . 0.0 112.089 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.498 ' CD2' HD11 ' A' ' 57' ' ' LEU . 4.2 m-90 -116.36 146.82 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.097 178.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.478 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -83.46 113.97 21.14 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.36 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.553 ' HB2' HD12 ' A' ' 77' ' ' ILE . . . -121.58 147.01 46.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.916 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tm-20 -123.0 115.45 21.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.337 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.551 HG11 ' CG2' ' A' ' 15' ' ' ILE . 10.7 m -73.27 122.99 27.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.243 0.544 . . . . 0.0 110.499 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 2.5 mttt -59.94 -26.31 65.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.847 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.649 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 54.1 t0 -105.81 125.69 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 111.828 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -41.09 99.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.283 0.563 . . . . 0.0 109.645 179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -100.03 24.13 8.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.541 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.649 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 3.5 p -40.93 152.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.215 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.667 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 3.0 pm0 -62.16 139.81 58.45 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.331 0.586 . . . . 0.0 111.161 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.582 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.6 mm -124.52 96.95 4.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.705 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.667 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -101.6 99.67 9.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.436 -178.702 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.536 HD22 ' CG2' ' A' ' 110' ' ' ILE . 12.9 mt -92.82 161.18 14.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.912 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -113.57 -169.24 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.389 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -65.99 -13.96 60.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.225 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -84.97 -18.97 32.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.038 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 34' ' ' LEU . 63.1 m-70 -134.3 109.65 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.726 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -88.99 2.13 54.45 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.0 160.61 6.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.062 0.458 . . . . 0.0 111.673 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.582 ' CE2' HG13 ' A' ' 110' ' ' ILE . 40.2 p90 -140.13 173.02 11.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.51 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.422 ' CZ ' HD23 ' A' ' 122' ' ' LEU . 28.4 mtp180 -157.14 156.31 32.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.217 0.532 . . . . 0.0 111.967 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.433 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.3 m95 -122.35 107.13 11.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.471 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.676 HD12 ' CD1' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -139.33 172.15 13.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.064 0.459 . . . . 0.0 111.794 -178.322 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.82 -154.5 7.93 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.956 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 tp -76.39 -41.83 46.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.745 0.307 . . . . 0.0 111.291 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.9 pt-20 -61.21 -50.3 73.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.404 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.805 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.29 -42.67 65.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.715 -179.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.463 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.58 -30.6 68.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.9 m -82.45 -35.75 27.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.805 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -61.37 -43.17 99.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.78 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.676 ' CD1' HD12 ' A' ' 122' ' ' LEU . 1.5 mt -77.6 -44.7 27.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.002 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.99 56.1 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.017 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.91 -34.92 0.17 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.186 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.408 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 9.8 m-85 -53.36 114.87 1.64 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.4 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.36 -50.18 12.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.28 -179.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.508 ' HB3' ' CD1' ' A' ' 85' ' ' LEU . 23.7 mp0 -48.14 -53.1 17.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.516 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.11 -47.25 85.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.324 -179.087 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.5 -40.41 37.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.958 0.409 . . . . 0.0 110.352 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.91 -47.86 60.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.945 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.414 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -52.11 -44.31 64.38 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.241 0.543 . . . . 0.0 109.919 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.88 -27.3 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.078 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.548 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.82 -52.41 37.2 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.01 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.74 -28.89 62.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.441 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.474 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.21 -40.77 97.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.65 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 29' ' ' ILE . 1.2 t-160 -79.0 -27.39 43.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.033 0.444 . . . . 0.0 110.466 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -73.46 -52.49 13.47 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.269 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -58.97 -52.2 66.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.138 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.678 HD12 ' CZ ' ' A' ' 16' ' ' PHE . 74.5 mt -53.99 -42.81 69.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.449 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -13.03 60.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.478 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.48 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.231 0.124 0 CA-C-O 121.115 0.483 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -105.41 130.14 53.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.651 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.44 120.79 25.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.446 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.02 170.92 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.411 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.2 m -159.58 123.98 3.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.504 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.73 178.97 19.12 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.765 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.696 HD21 ' HB3' ' A' ' 101' ' ' ALA . 1.1 mt -133.6 118.02 17.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.969 0.385 . . . . 0.0 111.469 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.616 HG13 ' HB3' ' A' ' 98' ' ' TYR . 51.2 mt -87.52 91.64 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 20.1 mt -78.12 146.29 8.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.587 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.65 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 35.9 p90 -150.04 123.24 8.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -81.66 113.07 19.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 120.96 0.409 . . . . 0.0 112.046 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 120.947 0.403 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.65 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -117.2 140.98 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.433 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.3 mp0 -126.91 138.51 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.889 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 49.8 m-85 -100.59 152.24 20.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.97 0.414 . . . . 0.0 112.05 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.486 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 53.0 tp -84.02 134.37 34.63 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.774 178.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.515 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.6 mt -132.62 142.41 49.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.863 0.363 . . . . 0.0 110.951 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.482 HD13 ' HG3' ' A' ' 46' ' ' PRO . 3.4 mt -123.11 104.92 9.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.891 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.466 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 3.1 tt0 -59.88 133.68 56.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.656 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.811 0.339 . . . . 0.0 110.603 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.541 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 63.7 m95 -97.38 130.52 44.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.173 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.62 136.37 10.02 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.405 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 18.2 Cg_endo -57.37 179.91 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.866 2.377 . . . . 0.0 112.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.482 ' HG3' HD13 ' A' ' 34' ' ' LEU . 21.7 Cg_exo -63.91 117.09 4.11 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.644 2.229 . . . . 0.0 112.543 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.82 128.91 55.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.408 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.36 173.37 14.72 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.351 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -109.99 103.63 12.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.914 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.502 ' HA ' ' OG1' ' A' ' 59' ' ' THR . 2.1 p -86.7 121.91 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.919 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.52 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 1.5 tt0 -93.73 154.01 41.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.971 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.52 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 3.4 Cg_exo -42.4 -46.44 7.72 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.745 2.297 . . . . 0.0 112.35 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.64 -11.46 82.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.107 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -85.29 164.33 18.08 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.855 0.327 . . . . 0.0 110.969 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.821 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 25.1 t70 -85.08 159.24 20.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.208 0.528 . . . . 0.0 110.772 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -71.42 -66.42 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.481 HD11 ' CD2' ' A' ' 99' ' ' TRP . 12.1 tp -59.23 -40.44 85.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.279 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.821 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.85 -50.54 45.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.856 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.502 ' OG1' ' HA ' ' A' ' 50' ' ' VAL . 24.3 m -55.47 -36.05 66.18 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HB3' ' HG ' ' A' ' 13' ' ' LEU . . . -75.84 -32.67 59.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.758 178.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.7 mt -73.37 -53.28 11.13 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.044 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -57.9 -43.66 86.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.147 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.79 -34.66 73.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.582 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.444 HG22 ' CD1' ' A' ' 15' ' ' ILE . 28.4 m -59.39 -53.63 55.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.521 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.506 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 4.9 pt20 -74.12 -21.44 59.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.17 -35.82 41.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 110.968 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -112.24 6.63 19.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.85 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.506 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -151.49 -12.15 0.21 Allowed 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.483 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 77.64 -2.76 62.24 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.29 -0.957 . . . . 0.0 112.784 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.506 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.9 mt -100.38 124.77 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.905 0.384 . . . . 0.0 110.831 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -108.58 167.05 10.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.767 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.515 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -45.85 -38.54 7.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.648 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.38 -20.53 73.56 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.241 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.423 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.5 tp60 -96.59 -5.68 38.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.519 0.199 . . . . 0.0 111.021 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.515 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.08 -168.81 2.15 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.906 0.384 . . . . 0.0 110.369 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 87.7 m -137.11 100.74 4.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.654 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.46 HD13 HD23 ' A' ' 61' ' ' LEU . 8.1 mm -72.94 125.27 31.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.962 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.483 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.62 133.38 29.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.292 0.568 . . . . 0.0 111.41 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.16 151.92 20.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.205 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 99.76 -22.24 41.33 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.657 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.488 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 14.2 t80 -106.03 131.7 53.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 110.911 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.481 ' HD2' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.25 131.92 8.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.232 0.539 . . . . 0.0 111.109 179.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -159.39 139.32 11.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.081 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.656 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.4 OUTLIER -126.39 134.27 51.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.913 0.387 . . . . 0.0 111.359 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.4 mt -93.18 118.74 31.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.98 125.67 53.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.858 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.417 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 22.2 p90 -166.85 142.67 4.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.844 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 7.4 p -81.73 112.34 19.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.019 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.4 -107.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -35.84 78.92 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.928 0.394 . . . . 0.0 110.748 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.93 28.55 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.857 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.643 ' HB3' HD12 ' A' ' 8' ' ' LEU . 1.9 tppt? -158.53 125.95 2.69 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.99 0.424 . . . . 0.0 111.321 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.607 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 58.2 Cg_endo -70.16 116.59 4.67 Favored 'Trans proline' 0 CA--C 1.513 -0.555 0 C-N-CA 123.358 2.706 . . . . 0.0 113.096 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.498 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -99.84 123.17 43.82 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.267 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.3 m -88.6 114.18 24.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.656 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.0 t -112.85 108.19 24.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.901 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.29 128.6 39.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.616 ' HB3' HG13 ' A' ' 14' ' ' ILE . 20.3 m-85 -117.95 128.58 54.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.241 0.543 . . . . 0.0 112.269 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.481 ' NE1' ' HD2' ' A' ' 82' ' ' LYS . 17.7 m-90 -109.99 167.48 10.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.579 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.488 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -103.03 110.91 23.0 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.537 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.696 ' HB3' HD21 ' A' ' 13' ' ' LEU . . . -118.23 154.49 32.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.465 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.9 tt0 -130.97 115.24 16.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.484 HG13 HD21 ' A' ' 75' ' ' LEU . 5.3 m -73.97 122.2 26.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 121.345 0.593 . . . . 0.0 111.273 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -24.12 66.25 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.166 -178.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.751 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.5 t0 -104.44 117.9 35.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.081 0.467 . . . . 0.0 112.041 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -57.62 -42.81 84.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.0 25.24 8.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.904 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.751 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -44.06 142.54 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.869 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -63.53 142.45 58.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.252 0.549 . . . . 0.0 111.422 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.532 HG13 ' CE2' ' A' ' 119' ' ' TYR . 36.5 mm -121.05 97.4 4.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.503 179.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.483 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 8.3 mtp180 -102.17 101.69 12.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.88 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.459 HD23 ' CG2' ' A' ' 110' ' ' ILE . 10.1 mt -90.73 178.72 5.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.353 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.66 -158.27 0.85 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.996 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -78.73 -3.45 44.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.4 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.78 -22.47 20.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.657 0.265 . . . . 0.0 111.104 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.37 116.71 17.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.41 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -87.57 -3.49 58.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.913 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -168.72 164.37 12.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 0.0 111.4 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' HG13 ' A' ' 110' ' ' ILE . 41.0 p90 -141.33 168.12 20.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.625 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.425 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 6.1 mtt180 -156.45 159.76 38.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.452 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.448 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.1 m95 -124.26 107.64 11.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.638 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.466 ' CD1' ' CD1' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -136.33 172.74 12.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.98 0.419 . . . . 0.0 111.342 -178.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.56 -153.99 7.29 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.959 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.9 tp -77.21 -42.41 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.649 0.261 . . . . 0.0 111.157 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.5 pt-20 -60.81 -50.08 74.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.316 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.769 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.22 -46.9 54.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.651 -179.401 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.515 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.03 -30.65 48.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.414 0.626 . . . . 0.0 109.636 178.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 6.5 m -83.71 -34.45 24.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.52 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.769 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.04 -41.44 99.5 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 121.091 0.472 . . . . 0.0 109.938 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.59 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.1 mt -77.89 -45.88 22.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.129 179.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.0 53.74 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.402 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.18 -31.49 0.05 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.585 -179.571 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -57.19 115.94 2.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.13 0.49 . . . . 0.0 110.412 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.85 -40.01 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.473 -179.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.8 mp0 -58.1 -54.08 50.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.72 -179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.54 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -63.42 -39.65 95.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.749 0.309 . . . . 0.0 110.489 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.79 -37.95 60.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.19 -46.01 36.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.946 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.424 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.25 -45.98 62.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.211 0.529 . . . . 0.0 110.314 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.52 -29.78 59.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.045 179.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.54 -51.33 60.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.792 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.56 -29.67 67.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.61 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.8 -44.94 94.04 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.986 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -78.78 -30.81 45.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -64.76 -52.36 57.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -61.56 -53.55 54.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.819 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.562 HD13 ' CE2' ' A' ' 16' ' ' PHE . 96.7 mt -56.02 -24.79 41.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.574 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.61 -10.93 56.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.532 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.871 179.623 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.801 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.516 -0.35 0 CA-C-O 121.696 0.76 . . . . 0.0 112.124 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.604 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -116.29 145.99 42.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.132 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.559 HH21 ' HD2' ' A' ' 56' ' ' ASP . 1.3 ttt85 -78.82 118.92 21.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.592 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.476 ' HB2' HG23 ' A' ' 96' ' ' VAL . . . -127.3 166.64 17.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.058 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.9 m -159.24 123.84 4.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.078 0.466 . . . . 0.0 111.762 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.484 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -120.61 171.92 14.87 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.496 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' A' ' 77' ' ' ILE . 0.6 OUTLIER -125.36 118.18 25.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 117.07 0.435 . . . . 0.0 111.976 -179.171 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.737 HG13 ' HB3' ' A' ' 98' ' ' TYR . 48.6 mt -86.24 91.74 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 30.3 mt -78.88 142.82 13.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.049 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.686 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.0 p90 -145.52 121.33 10.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.329 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 106' ' ' TYR . 20.3 tpt180 -81.0 113.34 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.916 0.389 . . . . 0.0 110.075 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.666 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.929 0.395 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.686 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.5 mt -115.93 141.61 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.976 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.549 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -128.84 141.77 51.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.991 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.58 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.7 m-85 -103.52 145.41 30.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.979 0.419 . . . . 0.0 111.843 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.564 HD21 HD13 ' A' ' 15' ' ' ILE . 52.1 tp -78.2 135.41 37.61 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.112 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.2 mt -134.23 145.4 49.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.002 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.485 HD13 ' CE1' ' A' ' 116' ' ' HIS . 6.6 mt -123.16 113.46 18.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.088 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.454 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.0 tt0 -76.64 147.69 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.559 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.092 179.762 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.843 0.354 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.495 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 65.7 m95 -102.12 135.02 44.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.8 153.38 27.47 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.6 172.88 15.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.73 2.287 . . . . 0.0 112.42 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 15.9 Cg_exo -66.11 86.58 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.617 2.211 . . . . 0.0 112.463 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.449 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 3.6 pttt -99.95 146.75 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.935 0.397 . . . . 0.0 110.892 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.28 -173.78 13.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.603 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 m80 -112.95 99.19 7.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.643 0.259 . . . . 0.0 110.72 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.497 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.4 p -67.01 130.54 32.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.048 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG2' ' N ' ' A' ' 52' ' ' PRO . 2.0 tt0 -96.93 151.11 37.56 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.243 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.443 ' N ' ' HG2' ' A' ' 51' ' ' GLU . 82.2 Cg_exo -39.63 -62.36 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.818 2.345 . . . . 0.0 112.463 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.31 -19.0 63.74 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.535 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -79.96 158.92 26.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.799 0.333 . . . . 0.0 110.657 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.864 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 6.0 t70 -83.33 163.26 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.289 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.559 ' HD2' HH21 ' A' ' 9' ' ' ARG . 0.8 OUTLIER -71.86 -64.39 0.94 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.154 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.552 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 26.5 tp -62.3 -42.88 99.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.418 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.864 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -49.15 -45.68 44.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.758 0.314 . . . . 0.0 110.497 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.497 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 84.9 m -55.81 -45.19 78.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.125 0.488 . . . . 0.0 109.889 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 -28.87 65.29 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.22 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 87.6 mt -72.78 -52.46 14.9 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.056 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -57.17 -46.89 82.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.779 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.03 -33.93 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 0.0 110.224 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.516 HG22 ' CD1' ' A' ' 15' ' ' ILE . 34.0 m -60.13 -52.31 65.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.506 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.509 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -79.19 -22.89 44.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.305 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -78.72 -36.63 43.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.688 0.28 . . . . 0.0 111.207 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 4.5 mm-40 -103.21 -18.09 15.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.721 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.48 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -125.04 -11.92 7.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.63 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 82.24 -10.78 52.8 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 119.85 -1.167 . . . . 0.0 112.423 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.509 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.5 mt -96.6 122.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 21.0 pm0 -105.64 171.53 7.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.088 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.516 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.59 -34.79 18.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.459 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -16.09 77.32 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.4 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.438 ' HB3' HG22 ' A' ' 70' ' ' ILE . 5.2 mm-40 -100.12 -10.57 21.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.547 0.213 . . . . 0.0 110.88 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.54 HD22 HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -127.32 -169.4 2.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.85 0.357 . . . . 0.0 110.276 179.286 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.9 m -135.76 100.64 4.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.114 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.456 HD13 HD21 ' A' ' 61' ' ' LEU . 11.3 mm -74.13 114.17 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.12 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.539 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -78.19 138.68 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 121.09 0.471 . . . . 0.0 110.826 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -95.54 149.4 21.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.0 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.22 -22.07 33.9 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.247 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.54 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 21.2 t80 -106.64 127.82 53.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.767 0.317 . . . . 0.0 111.16 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.94 127.88 6.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 111.73 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -151.74 138.61 18.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.8 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.692 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -119.8 123.62 44.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.946 0.403 . . . . 0.0 111.481 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.0 mt -91.08 116.19 28.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.654 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.9 p30 -117.06 130.54 56.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.125 0.488 . . . . 0.0 110.719 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.482 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 18.4 p90 -166.86 139.24 3.52 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.795 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.81 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 8.7 p -81.1 116.14 24.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.34 0.591 . . . . 0.0 111.259 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.63 -92.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.066 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -46.08 13.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.943 0.402 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -166.7 23.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.545 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.447 ' N ' ' CG2' ' A' ' 88' ' ' VAL . 0.2 OUTLIER -155.77 125.66 3.26 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.707 179.804 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.81 ' HA ' ' HA ' ' A' ' 88' ' ' VAL . 39.6 Cg_endo -68.37 -173.79 0.59 Allowed 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.137 1.892 . . . . 0.0 111.649 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -160.56 112.53 1.94 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.353 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.449 ' O ' ' N ' ' A' ' 10' ' ' ALA . 89.3 m -86.89 100.93 12.92 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.692 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 47.9 t -103.51 108.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.742 -178.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.638 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.22 123.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.737 ' HB3' HG13 ' A' ' 14' ' ' ILE . 29.8 m-85 -109.79 129.02 55.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.366 0.603 . . . . 0.0 112.579 -177.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.527 ' CD2' HD13 ' A' ' 57' ' ' LEU . 7.0 m-90 -115.16 149.59 37.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.985 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.512 HD22 ' CE1' ' A' ' 81' ' ' PHE . 4.0 mt -82.83 121.88 27.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.558 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -130.57 135.54 48.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.5 tt0 -113.59 117.48 31.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.71 0.29 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.54 HG11 HD22 ' A' ' 75' ' ' LEU . 6.4 m -74.79 112.81 12.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.361 0.601 . . . . 0.0 110.579 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -25.78 42.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.802 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.762 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 64.0 t0 -101.06 116.41 32.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.991 0.424 . . . . 0.0 111.101 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.434 ' CD1' ' HG2' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -61.82 -42.31 98.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.105 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.49 21.37 9.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.874 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.762 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.4 p -44.57 143.05 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.243 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -65.26 146.04 55.45 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.406 0.622 . . . . 0.0 111.221 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.571 HG13 ' CE2' ' A' ' 119' ' ' TYR . 40.1 mm -123.83 98.58 5.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.293 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.63 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 8.9 mtt-85 -96.88 105.78 17.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.426 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 67' ' ' GLU . 9.0 mt -99.63 120.87 40.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.958 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.28 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.658 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -87.63 19.36 3.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.612 0.244 . . . . 0.0 111.171 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -107.09 -43.73 4.55 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.485 ' CE1' HD13 ' A' ' 34' ' ' LEU . 45.3 m80 -98.24 132.6 43.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.703 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -93.03 -22.48 19.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.647 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.92 166.88 23.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 111.7 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.571 ' CE2' HG13 ' A' ' 110' ' ' ILE . 38.1 p90 -139.23 174.76 10.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.417 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 120' ' ' ARG . 0.1 OUTLIER -160.01 158.52 30.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.147 0.499 . . . . 0.0 111.624 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.443 ' CH2' HG21 ' A' ' 103' ' ' VAL . 85.8 m95 -123.0 106.96 11.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.62 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.34 165.27 26.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.83 -151.22 2.54 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.364 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.47 HD23 ' CD ' ' A' ' 141' ' ' GLN . 6.9 tp -76.55 -42.8 41.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.86 0.362 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -61.5 -52.49 64.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.83 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.672 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.92 -45.0 71.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.97 0.414 . . . . 0.0 110.615 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.16 66.36 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.266 0.555 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.52 -32.33 25.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.257 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -65.18 -44.49 88.32 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.525 ' HG ' ' NE2' ' A' ' 129' ' ' GLN . 1.2 mt -76.23 -44.81 35.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.753 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.09 55.34 1.79 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.814 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.75 -34.2 0.14 Allowed 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.415 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.457 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 14.1 m-85 -55.92 118.18 4.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.678 -179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -45.55 -50.91 12.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.52 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.457 ' OE2' ' HB3' ' A' ' 133' ' ' PHE . 31.0 mp0 -46.6 -54.69 8.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.776 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.756 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -64.21 -45.21 89.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.118 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.22 -41.7 50.33 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.501 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -70.64 -47.93 57.52 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.777 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.457 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.86 -42.75 62.88 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.138 0.494 . . . . 0.0 110.307 179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -31.55 42.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.95 178.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -63.52 -51.19 66.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.596 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.54 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -70.97 -27.63 63.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.936 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -59.05 -49.35 79.4 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.256 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.447 ' CD2' HD12 ' A' ' 29' ' ' ILE . 2.6 t-160 -74.3 -29.12 61.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.922 0.391 . . . . 0.0 110.624 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -67.41 -52.32 41.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.177 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -62.05 -53.14 59.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.21 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.539 ' CD2' HG12 ' A' ' 78' ' ' ILE . 76.6 mt -54.67 -28.34 46.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.851 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -10.95 59.71 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.866 0.365 . . . . 0.0 110.808 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.801 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.161 0 CA-C-O 121.231 0.539 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.582 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.24 128.13 54.45 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.096 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.57 116.59 19.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.658 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.496 ' CB ' ' HD3' ' A' ' 94' ' ' LYS . . . -132.78 168.82 17.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.047 0.451 . . . . 0.0 111.619 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.7 m -156.31 123.99 5.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.261 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.513 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.93 176.71 17.75 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.76 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.508 HD22 HD13 ' A' ' 77' ' ' ILE . 1.2 mt -129.96 120.87 25.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 117.237 0.519 . . . . 0.0 112.322 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.503 ' CG1' ' HB3' ' A' ' 98' ' ' TYR . 5.7 mm -80.63 91.77 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.564 ' CG2' HG12 ' A' ' 103' ' ' VAL . 75.7 mt -84.88 136.7 22.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.574 -177.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.691 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 45.2 p90 -150.17 131.16 14.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.283 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.539 ' HG3' ' CA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.66 113.95 24.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 110.334 178.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.435 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.633 0.254 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.687 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.3 mt -109.63 144.14 18.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.477 0.656 . . . . 0.0 112.094 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.623 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.0 mm-40 -124.1 172.67 8.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.589 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 40.4 m-85 -133.46 133.94 42.91 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.688 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.522 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 29.8 tp -75.38 134.58 40.92 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 6.3 mt -135.06 135.43 41.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.082 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.456 HD12 ' HG3' ' A' ' 46' ' ' PRO . 38.9 mt -112.51 102.3 10.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.655 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 5.2 tm0? -61.62 134.35 56.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 111.735 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.821 179.56 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.516 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 4.8 p-80 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.682 0.277 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.655 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 32.9 m95 -92.84 139.68 30.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.147 0.499 . . . . 0.0 111.957 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.434 ' HB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -157.9 139.12 9.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.002 179.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.423 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.3 Cg_endo -66.85 175.51 5.35 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.232 1.955 . . . . 0.0 112.001 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.486 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 32.1 Cg_exo -59.4 113.01 1.42 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.762 2.308 . . . . 0.0 112.55 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.434 ' NZ ' ' HB ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -112.5 141.44 46.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.829 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.51 167.8 21.28 Favored Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.629 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 48.8 m-70 -113.86 101.89 9.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.811 0.339 . . . . 0.0 110.706 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.507 ' N ' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -67.77 129.98 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.567 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -90.61 172.11 7.37 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.724 -179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.5 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 73.3 Cg_exo -50.03 -63.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.57 2.18 . . . . 0.0 112.733 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.03 10.38 58.14 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.292 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 16.7 tt0 -89.22 161.51 16.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.044 0.422 . . . . 0.0 110.912 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.88 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 8.6 t0 -86.81 162.94 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.763 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.48 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -75.15 -63.23 1.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.842 0.353 . . . . 0.0 111.224 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' HD11 ' A' ' 61' ' ' LEU . 26.8 tp -62.75 -40.89 98.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.88 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.36 -47.94 55.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.48 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.507 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.6 m -54.19 -42.61 69.92 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.472 ' HB3' ' HG ' ' A' ' 13' ' ' LEU . . . -70.16 -37.13 75.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.825 178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.538 HD21 ' CB ' ' A' ' 72' ' ' ALA . 96.2 mt -64.8 -52.7 55.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.593 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.467 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.4 tpt180 -62.87 -40.32 97.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.442 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.17 -32.22 73.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.06 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.513 HG22 ' CD1' ' A' ' 15' ' ' ILE . 63.5 m -65.1 -49.46 69.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.681 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.506 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -76.92 -22.88 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.877 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -79.29 -33.47 43.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.853 0.359 . . . . 0.0 111.228 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -106.74 -16.63 14.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.664 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.524 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -129.85 -6.81 4.51 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.473 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 75.25 -5.57 33.98 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.77 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.506 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.8 mt -98.97 124.22 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 CA-C-N 117.013 0.407 . . . . 0.0 110.529 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.457 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 9.6 pt-20 -110.31 170.65 7.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.106 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.555 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.44 -32.51 3.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.828 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.6 -25.75 74.51 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.088 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.457 ' HB3' HG23 ' A' ' 70' ' ' ILE . 11.2 mm-40 -94.41 1.47 55.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.409 0.147 . . . . 0.0 111.146 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 103' ' ' VAL . 0.0 OUTLIER -141.39 -173.92 3.89 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.924 0.392 . . . . 0.0 110.705 178.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.538 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 42.4 m -135.93 98.15 3.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.686 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.508 HD13 HD22 ' A' ' 13' ' ' LEU . 11.5 mm -68.69 107.72 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.453 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.58 133.09 32.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 121.274 0.559 . . . . 0.0 110.715 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -90.96 150.9 21.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.212 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.19 -25.67 22.83 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.092 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.514 ' CD1' HD23 ' A' ' 100' ' ' LEU . 21.7 t80 -102.43 119.96 39.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.8 0.333 . . . . 0.0 111.091 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.506 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -149.75 124.75 9.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.275 0.559 . . . . 0.0 110.86 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -148.79 138.14 21.76 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.669 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 2.7 pm0 -118.25 121.06 39.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.034 0.445 . . . . 0.0 111.047 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.618 HD12 ' HE2' ' A' ' 98' ' ' TYR . 5.5 mt -85.09 123.45 30.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.35 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.4 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.2 m-80 -115.45 120.29 39.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.642 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -167.33 141.18 3.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.818 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.485 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 11.6 p -81.46 109.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.238 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.53 -100.68 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.039 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -38.58 89.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 173.64 28.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.646 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.582 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -157.02 130.15 4.49 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.495 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.624 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 41.1 Cg_endo -65.46 120.12 7.26 Favored 'Trans proline' 0 CA--C 1.512 -0.594 0 C-N-CA 123.263 2.642 . . . . 0.0 112.368 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.553 ' HD3' HG21 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -103.74 127.24 51.23 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.859 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 84' ' ' GLU . 69.5 m -100.12 105.14 16.73 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.669 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 52.8 t -105.48 107.72 23.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.933 -178.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.606 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.76 111.47 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.618 ' HE2' HD12 ' A' ' 85' ' ' LEU . 7.4 m-85 -91.05 166.02 13.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.506 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -157.01 134.07 10.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.421 -179.552 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.514 HD23 ' CD1' ' A' ' 81' ' ' PHE . 1.3 mt -73.41 132.69 43.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.301 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.538 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -139.51 138.61 36.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.146 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.691 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.3 tt0 -108.85 109.52 20.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.895 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 105' ' ' ASP . 6.1 m -72.49 149.86 8.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.211 0.529 . . . . 0.0 111.39 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.15 -8.18 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.933 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.587 ' O ' HG22 ' A' ' 103' ' ' VAL . 3.2 t70 -149.47 117.88 6.49 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.165 0.507 . . . . 0.0 112.238 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.539 ' CA ' ' HG3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -49.68 -39.73 37.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.315 0.579 . . . . 0.0 110.365 178.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -101.54 25.0 8.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.877 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 105' ' ' ASP . 3.4 p -43.92 156.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.109 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.657 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 3.1 pm0 -60.94 139.7 57.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.274 0.559 . . . . 0.0 110.917 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.637 HG13 ' CE2' ' A' ' 119' ' ' TYR . 45.8 mm -122.14 99.52 7.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.429 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.473 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 2.4 mtt180 -102.7 96.61 6.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.317 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.499 HD23 ' CG2' ' A' ' 110' ' ' ILE . 5.6 mt -86.86 149.55 24.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.834 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.8 m -88.9 -170.14 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -71.49 -5.59 34.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.603 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.0 -24.3 18.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 110.965 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -106.52 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.642 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -123.72 -20.76 5.38 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -161.87 171.85 17.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.158 0.504 . . . . 0.0 111.857 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.637 ' CE2' HG13 ' A' ' 110' ' ' ILE . 46.1 p90 -149.43 177.73 9.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.504 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.4 mtt180 -166.6 162.91 16.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.316 0.579 . . . . 0.0 111.949 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -125.17 106.8 10.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.224 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.447 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -134.85 170.46 15.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 0.0 111.819 -178.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -77.31 -152.95 5.41 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.827 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 141' ' ' GLN . 5.7 tp -77.72 -42.93 32.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.69 0.281 . . . . 0.0 111.59 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.519 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.7 pt-20 -60.69 -49.69 76.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.488 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.1 OUTLIER -69.58 -52.35 26.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.93 0.395 . . . . 0.0 110.006 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 123' ' ' GLY . . . -50.56 -28.12 8.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.382 0.611 . . . . 0.0 109.68 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.406 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 1.0 OUTLIER -83.05 -38.3 22.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.871 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -58.34 -47.73 82.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.995 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.545 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -77.16 -40.34 45.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.491 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -76.74 54.62 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.634 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.34 -35.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.822 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 6.5 m-85 -58.43 120.62 9.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -46.77 -48.38 20.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.514 ' C ' HD13 ' A' ' 85' ' ' LEU . 2.1 mp0 -51.17 -53.37 35.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.486 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.491 ' CB ' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -58.62 -39.52 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.057 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.583 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -56.99 -44.94 83.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.935 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -66.52 -46.55 75.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.493 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -52.52 -44.63 65.87 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.939 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.9 -26.65 36.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.222 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.583 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.77 -51.81 37.1 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.723 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -74.57 -31.61 62.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.597 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.52 -48.3 60.96 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.165 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.431 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 8.2 t-80 -74.95 -32.25 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.041 0.448 . . . . 0.0 110.579 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 31.9 tp60 -64.85 -52.41 56.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.512 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -58.03 -54.16 50.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.262 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.577 HD11 ' CE2' ' A' ' 16' ' ' PHE . 72.5 mt -58.0 -32.17 67.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.857 -179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -15.99 58.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.787 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.666 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.121 0.486 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.689 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -102.71 132.91 48.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.643 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.599 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.65 122.64 28.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.319 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 95' ' ' THR . . . -135.73 165.57 25.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.752 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 57.8 m -154.41 123.22 6.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.145 0.497 . . . . 0.0 111.236 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.41 172.41 14.27 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.535 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.479 HD23 ' HB2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -126.65 117.17 22.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.018 0.409 . . . . 0.0 111.249 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.654 HG13 ' HB3' ' A' ' 98' ' ' TYR . 76.1 mt -83.95 90.84 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.636 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 43.2 mt -80.71 145.45 8.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.77 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.684 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 47.6 p90 -149.84 122.14 8.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.302 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.781 ' HD3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -81.54 112.9 19.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.274 179.268 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 120.796 0.332 . . . . 0.0 111.419 -179.676 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.822 0.344 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.684 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.4 mt -107.82 143.12 18.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.254 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.568 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 1.4 mt-10 -134.7 124.94 26.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.034 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.636 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.7 m-85 -89.66 144.6 25.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.609 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 43.1 tp -86.1 131.13 34.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.777 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.444 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.6 mt -129.69 140.16 51.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.618 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.506 HD13 ' HG3' ' A' ' 46' ' ' PRO . 10.7 mt -119.75 103.99 9.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.806 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -57.85 119.79 7.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.409 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 179.716 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.432 ' CE1' ' CG2' ' A' ' 44' ' ' THR . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.573 0.225 . . . . 0.0 110.605 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.58 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 48.9 m95 -108.13 110.19 21.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.844 0.355 . . . . 0.0 111.264 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.439 ' HB ' ' CD ' ' A' ' 47' ' ' LYS . 53.7 p -128.93 130.6 23.45 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.102 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.56 179.57 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.47 2.113 . . . . 0.0 112.102 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.629 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.6 Cg_exo -54.23 99.96 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.122 1.881 . . . . 0.0 112.093 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -99.34 140.83 32.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.862 0.363 . . . . 0.0 110.927 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.33 164.55 26.56 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.381 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -102.4 111.67 24.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.628 0.251 . . . . 0.0 110.582 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -86.45 134.34 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.447 0.641 . . . . 0.0 111.291 -179.681 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.737 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 9.0 tt0 -90.64 150.47 42.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.122 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.14 -23.37 22.22 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.761 2.307 . . . . 0.0 112.972 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.737 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.66 -11.24 38.58 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.509 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -84.66 166.51 17.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.875 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.4 t70 -80.35 159.0 25.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.214 0.531 . . . . 0.0 110.263 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.521 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.55 -66.39 0.63 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.734 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.55 HD13 ' CD2' ' A' ' 99' ' ' TRP . 30.9 tp -63.12 -38.06 89.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.437 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.875 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.84 -50.48 45.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.708 0.289 . . . . 0.0 110.498 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.468 HG22 ' CA ' ' A' ' 50' ' ' VAL . 53.9 m -54.62 -45.89 73.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 109.938 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.21 69.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.184 178.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.49 HD12 ' HG ' ' A' ' 57' ' ' LEU . 93.9 mt -74.6 -52.3 12.13 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.466 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -43.71 90.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.416 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.05 -32.83 72.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.388 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.629 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 87.5 m -61.55 -52.77 63.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.466 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.448 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.1 tt0 -75.06 -23.0 58.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.4 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -79.49 -40.05 30.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.877 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HE2' ' CB ' ' A' ' 115' ' ' GLU . 5.5 mm-40 -104.16 1.41 30.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.095 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.527 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -147.13 -12.44 0.42 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.545 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 78.87 -7.91 47.41 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.779 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.471 ' CG2' ' CD2' ' A' ' 75' ' ' LEU . 2.8 mt -96.32 122.49 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.529 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.461 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 6.0 pt-20 -104.48 167.42 9.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.559 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -47.23 -35.76 8.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.526 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.08 -23.77 76.04 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.018 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.46 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 3.6 tp60 -94.96 -5.65 44.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.793 0.33 . . . . 0.0 111.198 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.559 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.51 -170.99 2.54 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.443 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.458 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 35.7 m -137.75 100.86 4.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.524 HD13 ' HB2' ' A' ' 101' ' ' ALA . 13.3 mm -73.15 109.76 5.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.188 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.466 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -71.63 136.22 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.962 0.411 . . . . 0.0 110.427 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -93.72 149.74 20.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.511 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.0 -15.96 54.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.528 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.445 ' CZ ' HD21 ' A' ' 100' ' ' LEU . 18.9 t80 -104.78 135.62 45.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.76 0.315 . . . . 0.0 111.24 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.598 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.99 138.1 12.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.126 0.488 . . . . 0.0 111.437 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 142.78 5.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.347 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.692 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 2.5 pm0 -132.51 127.34 34.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.903 0.382 . . . . 0.0 111.176 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.623 HD11 ' HE2' ' A' ' 98' ' ' TYR . 8.3 mt -90.55 117.31 29.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.433 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -113.96 126.56 55.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.774 -178.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.434 ' CE2' ' OE1' ' A' ' 135' ' ' GLU . 22.3 p90 -167.71 141.58 3.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.01 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.668 ' O ' HG11 ' A' ' 88' ' ' VAL . 10.6 p -84.97 111.88 21.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.136 0.493 . . . . 0.0 110.246 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.26 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.442 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -80.0 -37.69 33.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.825 0.345 . . . . 0.0 110.704 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.67 26.99 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.169 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.689 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.62 122.09 2.66 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-O 120.899 0.381 . . . . 0.0 110.896 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.588 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 58.0 Cg_endo -71.68 118.21 5.53 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.223 2.615 . . . . 0.0 112.945 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.672 ' HD3' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -96.76 124.37 40.72 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.069 -179.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.7 m -94.14 110.25 21.98 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.692 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.5 t -109.89 107.57 23.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.386 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.621 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.62 128.74 39.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.654 ' HB3' HG13 ' A' ' 14' ' ' ILE . 26.2 m-85 -114.07 136.39 52.97 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.598 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.5 m-90 -123.37 146.07 48.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.128 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.465 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 3.1 mt -78.63 125.97 30.1 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -132.67 147.71 52.34 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.687 0.28 . . . . 0.0 111.388 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.463 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 7.5 tt0 -126.37 111.95 15.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.748 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.547 ' HA ' ' HA ' ' A' ' 75' ' ' LEU . 6.2 m -72.08 130.16 35.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.294 0.569 . . . . 0.0 110.81 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.55 -23.88 67.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.395 -177.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.672 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 5.7 t70 -107.13 130.23 54.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.074 0.464 . . . . 0.0 112.205 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.781 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 11.2 t80 -66.67 -37.08 84.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.931 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.61 26.4 10.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.064 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.672 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.8 p -43.8 146.86 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.925 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -71.3 142.55 50.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.344 0.592 . . . . 0.0 111.252 -179.166 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.588 HG13 ' CE2' ' A' ' 119' ' ' TYR . 43.0 mm -119.64 98.72 6.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.365 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.545 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 1.3 mtp85 -95.7 102.77 14.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.217 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.487 HD23 ' CG2' ' A' ' 110' ' ' ILE . 11.6 mt -100.24 139.85 35.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.804 179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.9 p -94.89 -154.94 0.44 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.601 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 19.12 1.06 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.521 0.201 . . . . 0.0 111.249 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' HE2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -103.85 -35.25 8.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.776 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.431 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 81.0 m-70 -117.74 139.78 50.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.968 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -92.92 -16.18 25.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.247 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.42 177.35 3.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 111.332 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.588 ' CE2' HG13 ' A' ' 110' ' ' ILE . 49.5 p90 -148.2 169.71 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.756 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.44 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -159.18 153.48 23.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.159 0.504 . . . . 0.0 111.746 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.466 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -114.49 107.08 15.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.507 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.423 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.24 167.55 21.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.489 -178.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -152.56 3.73 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.636 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.2 tp -76.96 -45.47 27.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.929 0.365 . . . . 0.0 110.967 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.6 pt-20 -56.99 -51.34 69.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.489 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.766 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.74 -46.74 62.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.938 0.399 . . . . 0.0 110.539 -179.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.444 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -55.66 -30.62 61.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.262 0.553 . . . . 0.0 109.635 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 3.1 m -84.26 -29.7 26.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.433 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.766 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.18 -42.67 88.56 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.979 0.419 . . . . 0.0 110.719 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.616 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -77.57 -45.1 26.34 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.762 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.542 ' CB ' ' HB3' ' A' ' 136' ' ' MET . . . -79.6 56.68 2.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.502 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -34.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.152 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.425 ' O ' ' HD3' ' A' ' 137' ' ' LYS . 10.0 m-85 -58.82 123.85 17.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.81 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.53 -54.67 7.21 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.609 ' HB2' ' CD1' ' A' ' 85' ' ' LEU . 0.0 OUTLIER -44.77 -57.88 3.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.918 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.542 ' HB3' ' CB ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.26 -36.5 75.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.009 0.433 . . . . 0.0 110.575 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -62.7 -37.88 88.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.923 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.55 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.84 -45.6 67.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.578 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.514 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -52.23 -44.92 65.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.246 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.25 -29.64 48.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.016 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.55 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -62.28 -51.67 66.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.165 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -70.49 -30.03 66.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.716 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.7 -51.65 43.11 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -77.34 -29.2 53.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.86 0.362 . . . . 0.0 110.659 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.23 -52.51 54.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.008 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -60.6 -54.75 41.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.8 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.549 HD12 ' CZ ' ' A' ' 16' ' ' PHE . 90.0 mt -54.73 -36.84 65.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.619 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 19.3 t -66.14 -13.16 59.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.063 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.37 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.26 0.552 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -107.65 139.88 41.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.563 179.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.455 ' HB3' HG11 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.37 118.18 23.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.982 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.403 ' CB ' ' HG2' ' A' ' 94' ' ' LYS . . . -129.81 165.67 21.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.977 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 11.2 m -157.79 123.94 4.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.203 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.585 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.2 172.91 14.62 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.182 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.478 ' HG ' ' HB1' ' A' ' 60' ' ' ALA . 2.1 mt -125.83 117.74 24.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.764 0.316 . . . . 0.0 111.386 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.645 HG13 ' HB3' ' A' ' 98' ' ' TYR . 51.9 mt -85.3 91.0 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.614 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 64.6 mt -79.13 139.86 17.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.096 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.605 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.4 p90 -144.13 121.16 11.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.41 -178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.84 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -87.34 118.59 26.88 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.69 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.6 ttm-85 . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.458 -179.219 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.806 0.336 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.605 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.5 mt -110.89 143.17 21.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.219 0.533 . . . . 0.0 111.791 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 11.7 mp0 -131.25 138.01 49.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.712 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.614 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.0 m-85 -101.38 152.23 20.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.047 0.451 . . . . 0.0 112.047 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 45.7 tp -86.72 138.51 31.57 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.96 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.3 mt -137.72 139.69 40.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.889 0.376 . . . . 0.0 111.006 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 116' ' ' HIS . 10.4 mt -119.2 109.3 15.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.127 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.561 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.0 tt0 -64.78 140.78 58.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.075 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.169 179.19 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.478 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 9.0 p-80 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.561 ' CZ3' ' HB2' ' A' ' 35' ' ' GLN . 40.1 m95 -98.63 145.1 27.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.663 -179.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -161.62 149.61 12.33 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.656 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.503 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 38.4 Cg_endo -65.01 166.69 17.86 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.535 2.157 . . . . 0.0 111.974 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 18.1 Cg_exo -66.51 87.88 0.27 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.64 2.227 . . . . 0.0 112.519 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.585 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.6 pttt -98.81 145.32 27.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.42 -166.04 12.02 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.879 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 102.49 8.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.624 0.25 . . . . 0.0 111.021 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.536 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.4 p -76.74 122.05 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.898 0.38 . . . . 0.0 110.752 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.491 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -78.12 172.81 8.85 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.768 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 52.6 Cg_exo -54.62 -56.47 2.43 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.387 2.058 . . . . 0.0 112.305 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.08 14.3 61.01 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.974 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.491 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 71.0 tt0 -94.22 158.96 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.863 0.332 . . . . 0.0 110.661 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.921 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.0 t70 -79.37 159.47 27.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.65 -58.87 3.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.347 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.453 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 37.1 tp -65.74 -39.79 91.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.84 0.352 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.921 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.45 -49.98 53.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.442 179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.536 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 85.9 m -54.34 -42.79 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.478 ' HB1' ' HG ' ' A' ' 13' ' ' LEU . . . -70.97 -30.56 66.86 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.098 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 89.5 mt -71.16 -52.68 17.87 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.69 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 ttp85 -60.73 -41.32 95.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.478 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.83 72.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.116 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.487 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 85.5 m -64.9 -49.9 68.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.432 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.46 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -77.43 -26.27 51.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.74 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -79.34 -35.9 40.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.822 0.344 . . . . 0.0 111.023 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.434 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.3 mp0 -106.75 0.92 24.53 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.733 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.59 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -148.3 -7.12 0.41 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.567 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 73.64 -4.87 26.01 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.056 -1.069 . . . . 0.0 113.121 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.489 HG21 HG13 ' A' ' 103' ' ' VAL . 1.5 mt -100.09 126.75 53.52 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.08 0 CA-C-N 117.214 0.507 . . . . 0.0 110.503 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.502 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.0 pt-20 -109.02 169.55 8.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.424 . . . . 0.0 111.722 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.547 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -47.86 -35.55 10.54 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.818 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.19 -22.06 78.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.131 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.442 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.6 tp60 -97.31 0.85 48.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.494 0.187 . . . . 0.0 111.397 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.547 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.28 -176.51 4.74 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.117 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.583 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 65.5 m -132.45 100.48 4.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 111.463 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.421 HD12 HD22 ' A' ' 13' ' ' LEU . 9.7 mm -70.17 119.06 15.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.803 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.498 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.59 134.38 27.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.148 0.499 . . . . 0.0 111.113 -179.602 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -93.79 150.97 19.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.312 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.13 -22.96 37.82 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.332 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.48 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 19.0 t80 -105.75 126.04 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.579 0.228 . . . . 0.0 110.847 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.495 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 2.2 ttpt -157.55 126.74 5.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.159 0.504 . . . . 0.0 111.615 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.492 HH21 ' HE2' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -149.09 139.43 22.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.845 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.643 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -122.29 137.81 54.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.111 0.481 . . . . 0.0 111.55 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.459 ' CD1' ' HB3' ' A' ' 135' ' ' GLU . 4.0 mt -103.75 120.7 41.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.583 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -110.95 127.7 55.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.778 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.5 p90 -166.95 141.72 4.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.929 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.644 ' O ' HG11 ' A' ' 88' ' ' VAL . 9.0 p -85.35 112.87 22.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.836 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.16 -95.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.525 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.81 -37.32 64.92 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-O 120.841 0.353 . . . . 0.0 110.712 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.434 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.0 t-20 178.21 26.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.105 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.569 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.01 124.4 3.4 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.049 179.716 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.604 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 67.6 Cg_endo -74.2 118.91 5.57 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 123.145 2.563 . . . . 0.0 112.376 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.408 ' HA ' HD13 ' A' ' 8' ' ' LEU . 4.4 ttpt -103.59 126.36 50.68 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.616 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.9 m -87.62 107.29 18.54 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 18.4 t -105.52 108.31 24.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.026 -178.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -86.24 129.51 38.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.8 m-85 -113.63 131.98 55.93 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.495 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.3 m-90 -119.58 140.69 50.16 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.774 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.468 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -77.67 133.11 38.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.645 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.583 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -142.03 140.93 32.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.795 0.331 . . . . 0.0 111.541 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.553 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 8.4 tt0 -113.15 111.6 22.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 75' ' ' LEU . 7.0 m -71.61 151.06 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.339 0.59 . . . . 0.0 111.65 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.488 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -75.7 -7.6 54.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.927 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.545 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 9.7 t70 -143.89 115.1 7.95 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-O 121.154 0.502 . . . . 0.0 112.349 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.84 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 0.4 OUTLIER -49.35 -40.21 34.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.694 178.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -102.95 24.72 10.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.793 178.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.545 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.3 p -43.52 151.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.667 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 2.6 pm0 -61.24 138.78 58.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.346 0.593 . . . . 0.0 110.193 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.612 ' CG2' HD22 ' A' ' 112' ' ' LEU . 33.6 mm -121.87 98.07 5.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.295 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.567 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 21.6 mtp180 -97.1 105.64 17.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.196 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.612 HD22 ' CG2' ' A' ' 110' ' ' ILE . 13.7 mt -92.21 155.49 17.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 111.371 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.07 -168.06 1.54 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.641 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -67.1 -18.5 65.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.442 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -84.3 -14.24 50.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.652 0.263 . . . . 0.0 111.521 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 92.7 m-70 -117.99 164.26 15.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.967 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -138.56 -28.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.715 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.8 158.6 37.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.93 0.395 . . . . 0.0 111.619 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.534 ' CE2' HG13 ' A' ' 110' ' ' ILE . 44.4 p90 -135.81 173.51 11.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.446 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.481 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 13.6 mtt85 -156.64 156.42 33.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.304 0.573 . . . . 0.0 111.671 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -120.49 107.17 12.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.659 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.485 HD22 HD12 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.59 170.51 15.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.998 0.428 . . . . 0.0 111.714 -178.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.39 -159.8 20.96 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.147 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.493 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.4 tp -69.61 -41.32 75.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.709 0.29 . . . . 0.0 111.475 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -62.87 -51.06 68.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.587 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.42 -51.2 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.838 0.351 . . . . 0.0 110.494 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -51.1 -31.1 18.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.261 0.553 . . . . 0.0 109.638 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 7.0 m -83.39 -29.11 28.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.295 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.549 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -66.91 -45.18 78.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.549 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -75.23 -43.46 51.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.69 51.67 1.11 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.911 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.42 -33.57 0.1 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.527 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.463 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.6 m-85 -55.79 118.54 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.329 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.72 -50.84 13.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.463 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 17.3 mp0 -46.94 -51.02 17.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.021 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.45 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -67.4 -39.96 85.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.72 0.295 . . . . 0.0 111.139 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -54.64 -33.98 61.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.092 179.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.492 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.52 -45.41 21.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.652 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.567 ' HB3' HD12 ' A' ' 14' ' ' ILE . . . -51.98 -48.15 64.51 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.395 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.25 -26.65 59.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.245 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.43 -51.93 38.34 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.967 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.48 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 5.1 mp0 -69.27 -28.97 66.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.251 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.523 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.83 -43.29 99.41 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.719 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -75.91 -27.75 57.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -70.94 -52.47 19.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.355 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.71 -53.83 53.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 83.4 mt -54.77 -29.4 53.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.594 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -13.42 62.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.729 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.308 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.657 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.19 0 CA-C-O 121.137 0.494 . . . . 0.0 111.694 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.653 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -114.14 141.67 47.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.732 -179.765 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.434 ' C ' HG12 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -80.66 126.56 31.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.773 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.677 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -137.72 161.62 36.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 m -156.44 123.08 5.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.17 0.51 . . . . 0.0 111.288 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.69 176.99 17.24 Favored Glycine 0 N--CA 1.446 -0.633 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.201 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -130.71 117.64 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.139 0.47 . . . . 0.0 111.177 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.687 HD13 ' HB2' ' A' ' 139' ' ' ALA . 39.5 mt -84.13 90.3 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.647 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.605 ' CG2' HG11 ' A' ' 103' ' ' VAL . 83.2 mt -79.93 145.36 9.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.413 -178.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.633 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 47.9 p90 -152.6 127.72 9.76 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.124 -178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -96.76 113.69 25.27 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.692 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.483 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.827 0.346 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.577 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.0 mt -106.15 150.85 8.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.42 0.628 . . . . 0.0 111.713 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 37.4 mm-40 -120.72 173.5 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.033 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.514 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 21.9 m-85 -141.37 128.75 21.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.598 0.237 . . . . 0.0 111.218 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.547 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 39.6 tp -73.0 140.45 47.34 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.52 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.0 mt -139.91 145.32 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.972 0.415 . . . . 0.0 111.074 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.441 HD13 ' N ' ' A' ' 46' ' ' PRO . 7.9 mt -123.77 112.22 17.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.238 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.456 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt0 -72.09 147.78 46.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.204 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.228 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.386 -179.927 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.749 0.309 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.583 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.4 m95 -109.63 117.83 34.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.194 0.521 . . . . 0.0 111.499 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 70.7 p -140.86 145.3 39.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.195 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.7 170.71 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.995 1.797 . . . . 0.0 111.452 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.548 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 53.6 Cg_exo -52.03 95.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.328 2.019 . . . . 0.0 112.541 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER -88.55 130.08 35.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.727 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.78 123.72 2.11 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.612 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.677 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 7.0 p80 -67.31 120.21 13.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.509 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.508 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.5 p -83.32 140.09 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.122 0.487 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.708 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 5.6 tt0 -91.76 149.49 39.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.93 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.7 Cg_endo -55.27 -20.82 26.39 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.958 2.438 . . . . 0.0 113.355 -178.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.59 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.56 -11.68 43.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.619 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -90.56 168.56 11.72 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.027 0.442 . . . . 0.0 110.911 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.8 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.1 t70 -81.76 160.79 23.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.46 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -69.21 -66.93 0.52 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.578 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.515 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 29.1 tp -62.21 -38.04 87.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.166 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.8 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -51.08 -46.82 61.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.721 -179.705 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.508 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 95.9 m -55.83 -46.46 78.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.4 -31.77 73.04 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.981 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 95.1 mt -72.14 -52.32 17.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.464 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.474 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 12.2 ttt-85 -62.41 -36.85 83.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.841 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 59' ' ' THR . . . -65.06 -31.65 72.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.548 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 24.4 m -62.51 -52.31 63.99 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.526 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.528 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -74.43 -24.38 59.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.739 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.6 -36.67 37.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.816 0.341 . . . . 0.0 110.597 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.69 10.58 22.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.683 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.572 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -158.53 -4.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.572 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 67.41 2.13 18.77 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.342 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.528 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.5 mt -104.28 125.75 59.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 117.085 0.442 . . . . 0.0 110.363 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -107.94 170.44 7.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.282 -179.435 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.526 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -48.69 -31.63 7.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.212 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.38 -26.41 74.21 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.889 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.534 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 1.2 mm-40 -96.25 2.17 52.7 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.526 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -140.79 -179.15 5.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.047 0.451 . . . . 0.0 110.465 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.498 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.1 m -131.59 100.1 5.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.124 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.461 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 11.1 mm -71.1 112.29 5.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.022 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.456 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -74.18 134.07 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.026 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -93.16 150.93 20.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.74 39.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.16 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.422 ' CE1' HD22 ' A' ' 100' ' ' LEU . 21.1 t80 -104.41 123.49 47.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 110.607 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.47 128.69 6.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.276 0.56 . . . . 0.0 111.663 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.435 ' HE ' ' HA ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -158.38 142.71 15.87 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.415 179.255 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.684 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.5 OUTLIER -120.07 133.18 55.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.073 0.464 . . . . 0.0 111.93 -179.343 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.419 HD21 ' HD3' ' A' ' 83' ' ' ARG . 13.5 mt -97.53 116.19 29.27 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.731 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.605 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.2 p30 -115.53 133.34 56.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 111.506 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -166.74 140.07 3.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.64 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.542 HG12 ' O ' ' A' ' 88' ' ' VAL . 8.9 p -81.26 107.19 13.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.338 0.59 . . . . 0.0 110.361 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.32 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.777 -178.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -77.01 -35.0 57.37 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.309 . . . . 0.0 110.992 -179.748 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.4 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 1.2 m-80 171.84 29.19 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.684 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.653 ' HB3' HD13 ' A' ' 8' ' ' LEU . 7.1 tptt -158.84 123.63 2.23 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.269 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.657 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 33.3 Cg_endo -67.9 121.1 8.1 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.988 2.459 . . . . 0.0 113.245 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.605 ' O ' ' HA ' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -94.87 113.62 25.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.806 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.3 m -87.76 105.5 17.43 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.684 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 39.5 t -108.03 108.38 25.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.13 122.54 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.579 ' HB3' HG13 ' A' ' 14' ' ' ILE . 40.4 m-85 -102.92 147.16 27.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -177.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.475 ' CD2' HD12 ' A' ' 57' ' ' LEU . 1.1 m-90 -135.07 138.39 43.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.347 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.469 HD11 ' HG ' ' A' ' 147' ' ' LEU . 0.7 OUTLIER -74.55 135.43 42.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -139.75 139.11 36.4 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 120.777 0.322 . . . . 0.0 111.796 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.633 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 13.3 tt0 -113.09 107.94 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.256 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.605 HG11 ' CG2' ' A' ' 15' ' ' ILE . 9.0 m -72.1 139.76 19.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 121.329 0.585 . . . . 0.0 111.574 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.534 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 2.7 mptp? -69.25 -18.22 63.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.511 -178.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.645 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 18.8 t0 -124.25 127.77 48.18 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.511 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 t80 -60.65 -45.09 95.44 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.984 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -98.02 23.9 7.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.074 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.645 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.1 p -42.26 143.75 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.136 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -61.05 142.09 56.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.303 0.573 . . . . 0.0 111.144 -178.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.572 ' HA ' ' O ' ' A' ' 68' ' ' ALA . 28.7 mm -124.55 96.46 3.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.093 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.572 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 1.4 mtt180 -98.88 102.53 14.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.666 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.502 HD23 ' CG2' ' A' ' 110' ' ' ILE . 11.0 mt -88.61 -178.59 5.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.6 m -127.45 -168.13 1.84 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.275 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.43 -13.42 62.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.578 0.214 . . . . 0.0 111.578 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.84 -18.88 29.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.35 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.424 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 98.5 m-70 -131.04 123.36 28.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.483 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.95 0.5 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.115 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.16 160.2 6.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.937 0.399 . . . . 0.0 111.612 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.519 ' CE2' HG13 ' A' ' 110' ' ' ILE . 38.7 p90 -142.03 174.36 10.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.744 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.416 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 15.4 mtt180 -159.46 159.69 33.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.262 0.553 . . . . 0.0 111.784 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -121.45 107.26 12.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.787 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -141.09 168.33 20.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 111.829 -178.639 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.48 -151.77 4.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.908 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 15.5 tp -76.91 -49.06 16.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.778 0.323 . . . . 0.0 111.151 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -52.53 -52.09 56.43 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.614 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.785 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -69.57 -51.25 37.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.079 0.466 . . . . 0.0 110.436 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.52 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.93 -29.28 19.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.032 178.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.7 m -84.36 -33.86 23.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.49 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.785 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.67 -42.9 95.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.954 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.618 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -78.15 -44.69 25.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.185 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.454 ' O ' ' HD2' ' A' ' 137' ' ' LYS . . . -76.78 55.69 1.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.097 0.475 . . . . 0.0 109.934 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.445 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.19 -32.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.379 -179.215 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.502 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 45.8 m-85 -57.98 119.21 6.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.538 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.06 -46.75 33.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.735 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.502 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 0.1 OUTLIER -51.18 -51.25 55.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.891 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -41.34 98.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 110.188 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -55.9 -35.28 66.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.75 178.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.487 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.05 -44.65 25.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.171 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.687 ' HB2' HD13 ' A' ' 14' ' ' ILE . . . -52.83 -53.28 50.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.363 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -27.17 64.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.086 179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.487 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.22 -51.95 64.19 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.016 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.64 -27.0 60.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.518 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -53.92 -47.1 67.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.203 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -78.81 -34.04 45.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.001 0.429 . . . . 0.0 110.611 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -62.31 -52.3 64.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.247 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -60.66 -52.61 64.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.133 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 93.1 mt -55.85 -31.88 63.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.483 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.66 -14.63 60.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.615 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.104 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.515 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.635 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.108 0.48 . . . . 0.0 111.704 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.646 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -105.53 134.24 48.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.367 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 -80.31 118.24 21.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.724 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.52 ' HB2' ' HG3' ' A' ' 94' ' ' LYS . . . -134.65 166.88 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.659 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.7 m -157.04 123.78 5.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.053 0.454 . . . . 0.0 111.103 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.524 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -114.05 176.44 17.08 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.857 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.463 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -131.01 117.72 19.58 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.655 HG13 ' HB3' ' A' ' 98' ' ' TYR . 70.2 mt -82.92 90.88 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.635 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 20.1 mt -80.9 145.44 8.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.265 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.659 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.1 p90 -154.32 122.65 6.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.826 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.493 ' HG2' HG23 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -75.28 115.67 15.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.948 0.404 . . . . 0.0 110.729 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.236 179.903 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.67 0.272 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.659 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.1 mt -108.26 138.36 35.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.046 0.451 . . . . 0.0 111.873 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 60.0 mt-10 -134.19 119.44 18.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.973 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.9 m-85 -82.66 149.19 27.51 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 38.9 tp -88.45 135.49 33.45 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.719 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.474 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.3 mt -135.82 141.54 44.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.808 0.337 . . . . 0.0 110.701 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB3' ' CG ' ' A' ' 116' ' ' HIS . 19.4 mt -119.64 112.77 19.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.97 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.471 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.5 tt0 -74.35 138.49 43.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.197 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.139 179.173 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.897 0.379 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.59 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.9 m95 -106.03 119.48 39.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.49 141.79 19.77 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.133 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.63 158.44 8.11 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.719 2.28 . . . . 0.0 112.405 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 44.1 Cg_endo -66.62 101.28 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.723 2.282 . . . . 0.0 112.199 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.52 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.14 153.04 19.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.054 0.454 . . . . 0.0 111.561 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.13 164.19 22.23 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.273 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 8' ' ' LEU . 1.1 t-80 -96.54 102.85 14.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.645 0.26 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.595 ' N ' HG23 ' A' ' 59' ' ' THR . 1.3 p -71.26 130.72 35.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.08 0.466 . . . . 0.0 111.149 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.518 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -89.92 174.69 4.48 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.748 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.518 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 51.3 Cg_exo -56.0 -60.52 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.292 1.995 . . . . 0.0 112.462 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.92 7.28 63.35 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.928 -0.653 . . . . 0.0 113.471 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 41.6 tt0 -88.9 164.88 14.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 110.809 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.841 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -88.39 159.81 17.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.152 0.501 . . . . 0.0 110.631 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.66 -62.77 1.29 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.87 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 29.7 tp -64.43 -40.8 96.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.481 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.03 -46.4 52.92 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 120.589 0.233 . . . . 0.0 110.393 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.595 HG23 ' N ' ' A' ' 50' ' ' VAL . 44.6 m -55.89 -46.73 78.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.79 -27.92 67.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.465 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.3 mt -77.06 -52.13 9.86 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.686 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.62 -36.37 80.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.051 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 59' ' ' THR . . . -67.36 -33.76 75.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.202 0.525 . . . . 0.0 109.649 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.489 ' HA ' ' CG ' ' A' ' 46' ' ' PRO . 98.6 m -61.22 -55.79 28.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.573 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -68.21 -20.67 64.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.883 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -79.21 -45.58 19.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.908 0.385 . . . . 0.0 110.876 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 3.2 mp0 -104.96 9.87 34.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.628 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -149.75 -9.36 0.3 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' A' ' 65' ' ' GLN . . . 69.93 0.94 29.76 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.01 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.573 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -106.3 130.81 57.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 117.087 0.444 . . . . 0.0 110.913 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -113.24 172.85 6.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.507 ' HB1' HD21 ' A' ' 61' ' ' LEU . . . -52.95 -30.01 32.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.869 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.99 -10.84 78.35 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.162 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.417 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 8.4 mm100 -112.74 -14.46 13.11 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.718 HD21 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -122.1 -178.69 3.93 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.281 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 9.6 m -124.31 101.71 7.32 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.581 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.434 HD12 HD12 ' A' ' 13' ' ' LEU . 11.7 mm -78.0 123.59 35.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.69 179.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.5 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -87.97 136.88 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 0.0 111.372 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -94.54 151.29 19.46 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.939 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.34 -26.7 22.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.434 ' CD2' HD13 ' A' ' 100' ' ' LEU . 12.9 t80 -98.83 132.62 44.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.527 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -158.26 133.59 8.73 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.187 0.517 . . . . 0.0 111.388 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -160.21 143.13 13.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.739 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.703 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.9 pm0 -129.65 128.53 42.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.932 0.396 . . . . 0.0 111.118 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.502 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.4 mt -89.99 118.25 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.222 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.435 HD21 ' HA ' ' A' ' 95' ' ' THR . 2.2 m120 -111.07 124.46 52.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.502 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.6 p90 -167.7 141.34 3.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.257 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.491 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.3 p -83.89 111.22 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.369 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.01 -102.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.796 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -64.07 -35.65 81.43 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.77 0.319 . . . . 0.0 111.01 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.462 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 2.6 p-10 173.19 30.72 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.856 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.646 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.92 126.09 2.63 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.78 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.635 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 59.3 Cg_endo -72.43 119.28 6.03 Favored 'Trans proline' 0 CA--C 1.512 -0.601 0 C-N-CA 123.136 2.557 . . . . 0.0 112.455 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.52 ' HG3' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -100.49 130.2 46.54 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.528 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.435 ' HA ' HD21 ' A' ' 86' ' ' ASN . 96.1 m -97.03 101.53 13.12 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.703 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 40.2 t -103.33 108.33 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.784 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.607 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.66 122.74 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.655 ' HB3' HG13 ' A' ' 14' ' ' ILE . 25.3 m-85 -110.66 128.18 55.59 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.184 0.516 . . . . 0.0 112.001 -178.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.551 ' CD2' HD11 ' A' ' 57' ' ' LEU . 10.9 m-90 -108.06 169.31 8.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.766 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.434 HD13 ' CD2' ' A' ' 81' ' ' PHE . 2.2 mt -101.52 109.06 20.8 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.541 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -118.75 151.73 37.48 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.093 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.448 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.9 tm-20 -131.3 115.16 15.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.12 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.718 HG13 HD21 ' A' ' 75' ' ' LEU . 6.0 m -71.97 131.44 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.291 0.567 . . . . 0.0 110.632 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 74' ' ' GLN . 4.7 mttt -67.81 -26.04 65.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.178 -178.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.733 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 58.4 t0 -104.16 125.14 50.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.951 0.405 . . . . 0.0 112.047 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -62.24 -42.84 99.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.892 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.9 23.2 9.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.743 178.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.733 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.5 p -43.49 148.08 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.326 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.57 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -62.95 140.98 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.31 0.576 . . . . 0.0 111.745 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.663 HG13 ' CE2' ' A' ' 119' ' ' TYR . 33.0 mm -124.23 96.75 4.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.684 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -99.42 101.43 12.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.855 -178.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 9.2 mt -97.09 125.04 41.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.297 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.6 p -65.25 -164.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.422 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -80.29 13.96 2.16 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.676 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -104.54 -35.4 7.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.015 0.436 . . . . 0.0 110.68 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.49 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 42.0 m80 -107.25 123.32 48.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.608 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -92.5 -13.41 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.586 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -164.23 167.67 19.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.107 0.48 . . . . 0.0 111.761 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.663 ' CE2' HG13 ' A' ' 110' ' ' ILE . 40.8 p90 -146.63 168.54 21.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.512 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.438 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 18.8 mtt180 -156.08 156.55 34.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.136 0.493 . . . . 0.0 111.553 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.484 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 89.1 m95 -119.66 107.52 13.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.592 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.502 HD23 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -139.17 167.73 21.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.856 0.36 . . . . 0.0 111.601 -178.451 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -162.2 11.17 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.702 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 8.3 tp -67.92 -45.58 73.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.809 0.305 . . . . 0.0 111.048 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.412 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.4 pt-20 -55.14 -53.39 56.49 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.556 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.617 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.1 OUTLIER -68.81 -51.89 35.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.018 0.437 . . . . 0.0 109.84 179.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.474 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.25 -27.46 9.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.489 . . . . 0.0 109.782 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 124' ' ' LEU . 0.2 OUTLIER -83.0 -33.25 26.59 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.742 178.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.617 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -64.7 -45.83 84.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.788 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.59 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.2 mt -77.4 -36.98 52.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.199 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.781 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.67 49.66 1.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.648 179.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.77 -30.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.066 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.0 127.19 30.59 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.58 -56.59 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.001 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.502 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.77 -50.17 26.43 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.089 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.781 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.36 -36.51 75.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.497 -179.433 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -62.13 -32.61 73.22 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.773 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.09 -46.3 35.54 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.699 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.451 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -52.65 -44.66 66.28 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.052 0.454 . . . . 0.0 110.527 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.72 -24.83 41.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.435 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.522 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.06 -52.11 46.21 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.523 -179.469 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -72.66 -30.85 64.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.44 -47.27 84.59 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.742 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.514 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -75.0 -35.11 62.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.085 0.469 . . . . 0.0 110.17 179.296 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -65.09 -52.94 52.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.686 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -63.89 -53.78 45.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 111.159 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.544 HD12 ' CE1' ' A' ' 16' ' ' PHE . 94.9 mt -55.86 -28.54 57.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.737 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 41.2 t -73.72 -8.37 55.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.522 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.899 0.381 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -111.88 133.99 53.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.178 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.443 ' C ' HG11 ' A' ' 50' ' ' VAL . 3.6 ttt-85 -79.53 119.85 23.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.476 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -132.49 163.46 28.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.109 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 46.1 m -156.24 123.85 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.056 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.546 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.64 174.06 15.07 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.75 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.468 HD11 ' CD1' ' A' ' 77' ' ' ILE . 0.9 OUTLIER -124.95 118.15 25.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.126 0.463 . . . . 0.0 111.872 -179.229 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.661 HG13 ' HB3' ' A' ' 98' ' ' TYR . 52.3 mt -82.44 91.68 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.703 HD11 HD22 ' A' ' 32' ' ' LEU . 25.8 mt -83.75 146.46 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.1 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.645 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.45 122.68 7.16 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.657 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.543 ' CZ ' ' HG3' ' A' ' 30' ' ' GLU . 1.2 ppt_? -83.29 112.86 20.27 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.014 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.429 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 5.3 ttp180 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.401 -179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 121.0 0.429 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.645 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -116.09 137.28 50.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.178 0.513 . . . . 0.0 111.866 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.584 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -136.12 126.81 27.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.468 179.196 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.652 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.5 m-85 -86.75 147.41 25.86 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.703 HD22 HD11 ' A' ' 15' ' ' ILE . 42.5 tp -84.04 133.08 34.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.676 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.437 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.7 mt -134.32 137.25 44.07 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.951 0.405 . . . . 0.0 110.815 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.458 ' HB2' ' CE1' ' A' ' 116' ' ' HIS . 2.2 mt -120.73 105.09 10.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.634 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.491 ' HB2' ' CZ2' ' A' ' 43' ' ' TRP . 1.7 tt0 -59.49 132.77 55.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.212 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.42 179.265 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.449 ' O ' ' HA ' ' A' ' 35' ' ' GLN . 6.9 p80 . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.785 0.326 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.56 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 81.0 m95 -120.2 101.99 8.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.638 179.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.5 p -126.37 154.32 74.85 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.563 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.511 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 63.4 Cg_endo -70.27 173.88 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.408 2.072 . . . . 0.0 111.969 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.64 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 21.9 Cg_exo -63.93 86.93 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.517 2.145 . . . . 0.0 112.082 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 1.2 pttt -96.21 152.26 18.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 111.054 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.14 -177.87 15.88 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.889 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.514 ' C ' HG23 ' A' ' 59' ' ' THR . 0.1 OUTLIER -107.0 115.92 31.02 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 110.504 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.526 ' N ' HG23 ' A' ' 59' ' ' THR . 1.5 p -90.42 128.84 42.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 121.241 0.543 . . . . 0.0 111.179 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.616 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 3.0 tt0 -92.06 153.51 43.3 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.799 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.616 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 5.2 Cg_endo -47.7 -43.21 29.06 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.968 2.445 . . . . 0.0 112.432 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.43 -15.21 78.77 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -83.53 164.42 19.82 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.798 0.332 . . . . 0.0 111.258 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.85 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 12.0 t70 -85.22 161.44 19.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.473 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.519 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 1.7 m-20 -72.64 -64.76 0.89 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.606 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.603 HD11 ' CD2' ' A' ' 99' ' ' TRP . 28.4 tp -63.43 -41.6 98.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.85 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.1 OUTLIER -49.86 -46.3 51.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.526 HG23 ' N ' ' A' ' 50' ' ' VAL . 55.1 m -55.8 -44.87 78.22 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.5 -30.06 68.81 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.927 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 91.7 mt -73.14 -52.42 14.25 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.26 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.1 84.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.327 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.58 -34.04 76.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.261 0.553 . . . . 0.0 109.806 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.64 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 39.6 m -59.12 -52.62 64.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.588 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.548 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.8 pt20 -74.59 -23.13 58.7 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.2 -35.45 48.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.899 0.38 . . . . 0.0 110.812 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.435 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 5.5 mt-10 -109.8 3.05 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.868 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -150.73 -6.97 0.28 Allowed 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.63 2.38 43.47 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 120.071 -1.061 . . . . 0.0 112.618 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.58 HG21 ' HB3' ' A' ' 74' ' ' GLN . 1.3 mt -105.85 128.16 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-O 120.878 0.371 . . . . 0.0 110.301 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.511 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 4.4 pm0 -112.19 172.23 7.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.482 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.512 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -52.67 -31.97 39.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.999 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.79 -6.42 81.76 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.175 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.762 HE22 ' HE2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -112.88 -14.36 13.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.548 0.213 . . . . 0.0 110.968 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.733 HD22 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -122.86 -171.07 2.21 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.528 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.6 m -130.91 98.78 4.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.251 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.521 ' CD1' ' HB3' ' A' ' 101' ' ' ALA . 12.3 mm -73.22 122.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.037 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.534 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -85.28 135.58 24.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -92.97 151.43 19.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.267 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.71 -23.18 37.09 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.524 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.452 ' CE1' HD22 ' A' ' 100' ' ' LEU . 19.8 t80 -102.13 126.11 49.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.841 0.353 . . . . 0.0 110.917 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.464 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.2 ttpt -158.1 125.18 4.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.191 0.52 . . . . 0.0 111.306 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.569 ' NE ' ' HE2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -146.9 137.54 23.76 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.612 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.72 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -121.08 127.5 51.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.991 0.424 . . . . 0.0 111.496 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.524 HD13 ' HE2' ' A' ' 98' ' ' TYR . 6.7 mt -92.73 117.34 29.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.225 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -107.02 123.76 48.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.3 -178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 25.5 p90 -166.88 143.48 4.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.16 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.67 ' O ' HG11 ' A' ' 88' ' ' VAL . 11.0 p -84.31 111.42 20.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.541 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.4 -106.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.241 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -41.55 88.47 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.927 0.394 . . . . 0.0 110.763 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 177.9 29.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.732 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.621 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -155.48 125.84 3.38 Favored Pre-proline 0 N--CA 1.452 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.562 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.624 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 55.9 Cg_endo -70.53 119.99 6.77 Favored 'Trans proline' 0 CA--C 1.513 -0.544 0 C-N-CA 123.179 2.586 . . . . 0.0 112.481 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.449 ' HD2' ' CD2' ' A' ' 49' ' ' HIS . 6.0 ttpt -106.89 119.02 38.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.96 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.438 HG23 ' HB2' ' A' ' 84' ' ' GLU . 47.7 m -82.19 107.74 15.12 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.72 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 46.3 t -104.28 107.97 23.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.914 -178.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.611 HD12 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.47 131.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.661 ' HB3' HG13 ' A' ' 14' ' ' ILE . 6.1 m-85 -116.24 136.74 52.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.287 0.565 . . . . 0.0 112.135 -177.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.603 ' CD2' HD11 ' A' ' 57' ' ' LEU . 8.9 m-90 -125.01 140.91 52.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.238 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 77' ' ' ILE . 0.5 OUTLIER -74.76 132.21 41.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.709 -0.396 . . . . 0.0 109.936 179.171 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.553 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -141.15 135.75 31.16 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.821 0.343 . . . . 0.0 111.549 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.581 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.8 tm-20 -113.55 115.8 28.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.257 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.733 HG13 HD22 ' A' ' 75' ' ' LEU . 16.3 m -71.89 122.25 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-O 121.159 0.504 . . . . 0.0 110.447 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.421 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 1.3 mttt -64.05 -22.34 66.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.661 -178.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.87 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -100.91 111.46 23.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.27 0.557 . . . . 0.0 111.711 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -56.69 -39.14 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.65 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -105.76 28.07 7.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.551 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.87 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.3 p -48.18 149.08 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.699 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.762 ' HE2' HE22 ' A' ' 74' ' ' GLN . 2.1 pm0 -72.24 144.0 48.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 110.577 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.602 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.6 mm -121.66 94.59 3.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.659 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.459 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.3 OUTLIER -97.59 98.61 10.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.715 -179.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.453 HD22 HD23 ' A' ' 34' ' ' LEU . 6.0 mt -83.09 174.64 10.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.7 p -116.18 -167.72 1.32 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -59.94 -43.48 94.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.997 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.37 -4.52 18.68 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.458 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 40.1 m-70 -120.99 144.45 48.5 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 111.314 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -127.53 -18.12 4.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.628 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.72 154.89 18.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.939 0.399 . . . . 0.0 111.421 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.602 ' CE2' HG13 ' A' ' 110' ' ' ILE . 37.8 p90 -136.65 168.15 20.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.41 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 119' ' ' TYR . 6.7 mtt180 -156.19 159.85 39.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.134 0.492 . . . . 0.0 111.598 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.3 m95 -121.33 109.28 14.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.644 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.561 HD21 HD13 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -138.32 168.33 19.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.028 0.442 . . . . 0.0 111.623 -178.712 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -74.56 -153.34 3.28 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.714 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.1 tp -77.13 -43.15 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.808 0.337 . . . . 0.0 111.063 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -59.19 -48.9 79.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.837 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.788 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.67 -41.0 63.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.933 0.397 . . . . 0.0 110.851 -179.376 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.437 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -61.22 -29.56 69.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.263 0.554 . . . . 0.0 109.515 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.3 -33.5 23.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.502 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.788 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.71 -42.73 95.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.636 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.613 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -77.35 -43.12 34.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.719 ' HB3' ' HB3' ' A' ' 136' ' ' MET . . . -79.71 57.71 2.58 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.73 178.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.5 -36.94 0.18 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.929 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.446 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 6.9 m-85 -54.62 118.98 4.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.766 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.09 -51.95 12.95 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.106 0.479 . . . . 0.0 110.605 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.488 ' HB2' ' CD1' ' A' ' 85' ' ' LEU . 0.0 OUTLIER -50.95 -53.35 33.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.564 179.917 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.719 ' HB3' ' HB3' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.74 -37.17 78.24 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -61.25 -34.95 76.0 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.65 -46.17 55.33 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.895 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -51.74 -45.71 63.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.099 0.475 . . . . 0.0 110.004 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.39 -29.69 57.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.525 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.22 -52.45 47.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.171 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.569 ' HE2' ' NE ' ' A' ' 83' ' ' ARG . 19.6 mt-10 -69.35 -30.63 68.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.422 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.16 -44.67 88.74 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.657 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.501 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 3.5 t-80 -78.19 -34.23 49.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.748 0.309 . . . . 0.0 110.351 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -61.82 -52.77 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.482 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.64 -50.43 69.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.105 0.479 . . . . 0.0 110.694 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.534 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.4 mt -57.21 -34.65 68.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.791 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -73.5 -17.48 61.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.697 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.718 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.707 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.636 0.731 . . . . 1.39 109.907 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.643 HD13 ' HB3' ' A' ' 92' ' ' LYS . 1.0 OUTLIER -72.26 125.73 28.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.655 -1.157 . . . . 1.53 111.618 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.441 ' HB3' HG12 ' A' ' 50' ' ' VAL . 4.9 ttt180 -78.47 111.53 14.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 3.07 110.057 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -129.02 168.38 16.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.776 -0.647 . . . . 1.23 110.796 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.444 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.1 m -157.11 122.41 4.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.71 110.905 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.99 171.98 14.09 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.557 -0.747 . . . . 0.47 111.421 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.433 ' HG ' ' HB1' ' A' ' 60' ' ' ALA . 0.9 OUTLIER -126.61 117.11 22.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.987 0.394 . . . . 1.13 111.103 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.531 HG13 ' HB3' ' A' ' 98' ' ' TYR . 84.3 mt -82.79 91.2 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.091 -1.077 . . . . 1.3 108.091 177.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.604 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 18.2 mt -78.44 145.39 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 114.913 -1.04 . . . . 1.08 111.087 -178.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.691 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.5 p90 -149.12 121.38 8.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 123.431 0.457 . . . . 2.13 111.49 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.94 111.64 17.59 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.791 -0.448 . . . . 4.98 109.791 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.234 0.241 0 CA-C-N 116.107 -0.497 . . . . 3.22 111.247 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.649 0.261 . . . . 1.31 110.971 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.691 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.8 mt -121.4 135.31 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-N 116.052 -0.522 . . . . 1.22 111.389 -179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.3 120.93 28.07 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.087 -0.506 . . . . 1.91 110.248 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.59 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 47.1 m-85 -82.1 149.62 27.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 2.19 112.209 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.604 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 52.4 tp -87.18 134.07 33.57 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.743 -0.662 . . . . 1.07 110.032 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.538 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.2 mt -133.69 134.64 43.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.34 -0.391 . . . . 1.13 111.085 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.44 HD13 ' HG3' ' A' ' 46' ' ' PRO . 20.7 mt -113.0 113.43 25.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.074 -0.512 . . . . 1.14 110.803 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -69.62 144.35 53.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.892 -0.594 . . . . 1.69 111.606 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.236 0 CA-C-N 115.972 -0.558 . . . . 1.39 110.362 179.086 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.775 0.321 . . . . 1.66 110.834 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.547 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 56.8 m95 -95.03 122.59 37.85 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.079 -0.509 . . . . 0.65 110.852 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -145.17 144.68 24.25 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.003 -0.544 . . . . 1.2 110.9 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.48 171.61 3.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.775 2.316 . . . . 1.15 112.221 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.531 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 19.8 Cg_exo -65.04 101.86 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.626 2.217 . . . . 0.71 112.264 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.14 142.87 30.07 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.207 -0.452 . . . . 2.39 110.97 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.55 176.71 18.13 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.104 -0.57 . . . . 0.78 112.56 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.1 103.89 12.68 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.726 0.298 . . . . 3.59 110.63 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.475 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.3 p -79.31 121.43 32.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 121.113 0.483 . . . . 1.45 111.106 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.41 158.38 54.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.5 -0.773 . . . . 1.98 109.978 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.73 -53.59 6.34 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.927 2.418 . . . . 1.61 112.453 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.84 -13.24 83.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 121.014 -0.612 . . . . 1.28 113.189 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -81.87 155.33 25.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.884 0.342 . . . . 1.43 111.114 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.807 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 34.9 t70 -79.27 158.3 27.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.244 -0.434 . . . . 1.33 110.702 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.45 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -69.3 -62.32 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.852 -0.613 . . . . 1.74 111.598 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.466 HD12 ' CE3' ' A' ' 99' ' ' TRP . 9.1 tp -62.51 -40.23 96.06 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.789 -0.187 . . . . 1.22 111.485 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -51.6 -40.76 60.43 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.972 0.17 . . . . 1.91 110.692 179.657 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.475 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 96.3 m -61.9 -46.96 87.09 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 110.057 -0.349 . . . . 1.29 110.057 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.433 ' HB1' ' HG ' ' A' ' 13' ' ' LEU . . . -62.24 -43.23 99.31 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 109.63 -0.507 . . . . 1.11 109.63 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.584 HD23 HD13 ' A' ' 77' ' ' ILE . 97.9 mt -60.39 -52.77 63.81 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.371 -0.831 . . . . 1.16 110.901 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -42.62 85.86 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.868 -0.606 . . . . 3.55 110.809 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.44 -35.64 79.89 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.29 -0.413 . . . . 1.14 111.098 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.532 HG22 ' CD1' ' A' ' 15' ' ' ILE . 63.5 m -63.99 -43.28 96.17 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.192 -0.458 . . . . 1.05 111.208 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.571 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 3.9 pt20 -80.08 -24.64 40.48 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.536 0.199 . . . . 2.22 111.536 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -79.93 -46.05 17.43 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.695 -0.23 . . . . 1.77 111.465 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 21.9 mt-10 -97.81 -11.45 23.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.679 0.622 . . . . 2.0 112.679 -179.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.511 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -131.96 -3.46 3.6 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.83 0.678 . . . . 1.07 112.83 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 69.65 6.34 54.77 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.391 -0.909 . . . . 0.39 113.546 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.571 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.4 mt -111.09 120.12 61.07 Favored 'Isoleucine or valine' 0 C--N 1.341 0.23 0 CA-C-N 117.378 0.589 . . . . 1.09 111.346 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.6 pt-20 -97.0 172.27 7.96 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 1.82 110.642 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.494 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -50.68 -42.01 56.36 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.998 0.37 . . . . 1.09 111.998 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.78 -25.7 71.87 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 120.998 -0.62 . . . . 0.48 112.742 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.532 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 5.9 tp60 -86.87 2.86 47.72 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 111.773 0.286 . . . . 2.09 111.773 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.611 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -139.48 -164.34 1.66 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.663 0.268 . . . . 1.1 110.5 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.4 m -143.02 100.85 3.72 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.331 -0.395 . . . . 1.18 110.168 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.584 HD13 HD23 ' A' ' 61' ' ' LEU . 9.2 mm -75.11 118.06 20.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.99 -0.55 . . . . 1.18 111.414 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.573 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -78.7 136.93 22.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.712 -0.677 . . . . 1.21 110.682 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.99 146.96 23.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.423 -0.808 . . . . 1.5 111.129 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.98 -28.36 15.61 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.822 -0.704 . . . . 0.79 113.063 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -98.88 128.91 45.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 2.17 111.633 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -158.25 126.87 5.48 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.707 -0.679 . . . . 1.9 110.655 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -152.01 129.57 11.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.586 . . . . 3.54 110.75 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.811 ' HB3' HD12 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -110.74 137.49 48.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.886 0.374 . . . . 1.42 111.248 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.419 ' CD1' ' HB2' ' A' ' 135' ' ' GLU . 8.8 mt -102.2 121.61 42.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.781 -0.645 . . . . 1.24 110.553 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -110.27 127.26 54.91 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.301 -0.409 . . . . 1.75 111.773 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.5 p90 -167.3 141.6 3.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.788 -0.642 . . . . 2.35 111.428 179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.9 p -82.77 112.6 20.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.49 -0.559 . . . . 1.54 109.49 177.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.76 -91.56 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.34 -0.391 . . . . 1.39 111.38 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -82.69 -44.76 15.3 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.877 0.37 . . . . 4.16 110.09 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -169.95 31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.869 -0.605 . . . . 2.79 111.0 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.643 ' HB3' HD13 ' A' ' 8' ' ' LEU . 8.7 tptt -161.16 126.19 2.17 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.981 0.42 . . . . 2.63 110.904 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.707 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 55.6 Cg_endo -66.41 121.34 8.59 Favored 'Trans proline' 0 N--CA 1.476 0.457 0 C-N-CA 123.745 2.963 . . . . 0.95 112.715 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.566 ' HG2' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -101.69 121.33 41.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.002 -0.545 . . . . 2.11 111.713 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.1 m -92.76 106.25 18.25 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.93 -0.767 . . . . 1.38 108.93 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.0 t -107.01 106.46 20.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 111.735 0.272 . . . . 1.15 111.735 -178.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.811 HD12 ' HB3' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -87.0 124.63 40.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.259 -0.645 . . . . 1.37 109.259 178.517 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.531 ' HB3' HG13 ' A' ' 14' ' ' ILE . 45.5 m-85 -109.01 158.04 18.1 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.876 0.695 . . . . 2.14 112.876 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.466 ' CE3' HD12 ' A' ' 57' ' ' LEU . 15.2 m-90 -141.39 157.98 44.47 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 114.762 -1.108 . . . . 0.79 109.82 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.573 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 2.0 mt -92.63 108.29 19.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.679 0.276 . . . . 1.18 110.261 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.469 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -117.97 125.29 50.11 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.432 -0.349 . . . . 1.08 110.645 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.517 ' HB2' ' CZ ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -104.93 113.89 27.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 1.38 111.093 -179.377 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.611 HG13 HD23 ' A' ' 75' ' ' LEU . 10.2 m -72.61 125.63 31.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 121.127 0.489 . . . . 1.16 110.404 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.5 ' HE2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -70.37 -16.49 62.98 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.667 -0.697 . . . . 1.97 112.646 -178.338 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.715 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 1.1 t70 -105.05 129.85 53.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.757 0.313 . . . . 2.39 111.042 179.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.4 -41.04 73.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 3.25 109.932 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.83 32.07 3.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.785 -0.643 . . . . 2.29 110.325 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.715 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.6 p -52.14 140.61 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 115.93 -0.577 . . . . 1.1 110.33 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -62.0 140.65 58.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.259 0.552 . . . . 1.26 111.693 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.58 HG13 ' CE2' ' A' ' 119' ' ' TYR . 41.4 mm -120.39 98.84 6.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.245 -0.889 . . . . 1.17 110.012 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.402 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 5.4 mtt180 -101.01 98.48 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.532 -0.758 . . . . 3.78 110.844 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.468 ' HA ' ' O ' ' A' ' 67' ' ' GLU . 6.4 mt -87.67 146.0 25.9 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.589 -0.732 . . . . 1.17 111.73 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.2 m -91.07 -172.35 3.29 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.709 -0.678 . . . . 2.07 110.718 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -60.28 -28.77 68.35 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.718 -0.219 . . . . 3.52 111.531 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.75 -44.52 73.58 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 111.798 0.295 . . . . 2.63 111.798 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -104.34 123.75 47.96 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 2.17 111.498 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -95.42 -26.34 15.9 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.076 -0.511 . . . . 3.28 111.814 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -141.61 168.12 20.52 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.03 0.443 . . . . 1.31 111.654 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.58 ' CE2' HG13 ' A' ' 110' ' ' ILE . 31.5 p90 -148.24 161.78 40.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.71 -0.677 . . . . 2.24 110.635 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -153.78 153.97 33.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.139 0.495 . . . . 2.71 111.655 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -117.28 106.94 13.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.256 -0.884 . . . . 0.48 109.049 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.53 HD21 HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -135.42 168.77 18.59 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.938 0.399 . . . . 1.17 111.829 -178.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.48 -158.13 6.95 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.835 -0.621 . . . . 0.47 112.209 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.4 tp -72.71 -45.79 56.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.596 0.198 . . . . 1.22 111.17 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.6 pt-20 -58.36 -48.65 79.9 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.128 0.418 . . . . 1.34 112.128 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.734 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.03 -42.09 60.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.689 -0.232 . . . . 1.28 111.041 -179.465 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.99 -31.01 69.51 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.844 -0.428 . . . . 1.1 109.844 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.65 -37.56 35.7 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.62 -0.718 . . . . 1.81 110.263 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.734 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -59.47 -42.67 92.57 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.402 -0.363 . . . . 1.29 111.042 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.592 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -78.22 -42.51 31.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.348 -0.387 . . . . 1.18 110.849 179.174 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.681 ' HB3' ' HB3' ' A' ' 136' ' ' MET . . . -79.04 56.41 1.98 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.202 0.525 . . . . 1.07 109.858 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.31 -39.48 0.28 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.824 -1.08 . . . . 3.28 111.951 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.852 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 56.5 m-85 -56.08 120.39 7.41 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.18 -0.464 . . . . 2.34 109.877 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -57.21 4.35 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.931 0.715 . . . . 2.33 112.931 -177.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.852 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 0.0 OUTLIER -47.58 -47.2 28.61 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.177 0.298 . . . . 1.71 111.391 -179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.681 ' HB3' ' HB3' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.07 -46.75 87.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.196 -0.298 . . . . 1.16 110.196 179.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -40.92 72.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.893 -0.594 . . . . 2.01 110.078 178.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.8 -41.88 74.47 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-N 115.97 -0.559 . . . . 1.21 111.143 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.51 -46.89 80.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.95 0.405 . . . . 1.11 109.967 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.434 HD13 ' O ' ' A' ' 136' ' ' MET . 1.5 mt -71.76 -31.16 66.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.625 -0.716 . . . . 1.1 110.042 178.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.49 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.89 -51.75 56.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.918 -0.583 . . . . 1.19 111.187 179.579 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.56 -31.7 71.11 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.097 -0.501 . . . . 2.28 110.928 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -60.2 -46.09 94.87 Favored Glycine 0 C--N 1.338 0.662 0 C-N-CA 120.786 -0.721 . . . . 0.49 111.655 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -72.12 -36.09 69.31 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.551 0.215 . . . . 1.94 110.537 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -64.7 -52.71 55.72 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.276 -0.42 . . . . 2.15 111.441 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -56.66 -51.38 68.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.084 -0.507 . . . . 2.22 111.065 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.533 ' CD2' HG12 ' A' ' 78' ' ' ILE . 87.5 mt -59.13 -37.26 76.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.112 -0.494 . . . . 1.24 111.671 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 2.0 t -70.45 -19.33 62.97 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.615 0.245 . . . . 1.31 110.72 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-N 116.372 -0.376 . . . . 1.42 111.503 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB1' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.984 0.421 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.591 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -114.47 126.17 54.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.517 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HB3' HG12 ' A' ' 50' ' ' VAL . 0.8 OUTLIER -78.19 123.82 27.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -142.83 160.03 41.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.122 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.462 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 80.0 m -150.72 123.79 8.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.176 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.404 ' O ' ' CB ' ' A' ' 60' ' ' ALA . . . -111.74 177.25 18.74 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.491 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -130.26 118.18 20.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.589 0.695 . . . . 0.0 112.328 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.524 HG13 ' HB3' ' A' ' 98' ' ' TYR . 78.8 mt -82.64 91.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.552 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 27.5 mt -81.51 145.9 8.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.339 -178.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.632 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 35.5 p90 -152.94 127.27 9.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.372 -178.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.486 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.08 113.02 23.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.006 0.431 . . . . 0.0 110.119 178.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.466 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.906 0.384 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.573 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.8 mt -102.39 149.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.705 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.632 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.8 mp0 -116.7 172.65 7.09 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.036 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 27.9 m-85 -135.14 129.11 33.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.564 0.221 . . . . 0.0 111.14 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.9 tp -71.95 133.08 45.15 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 4.0 mt -133.99 144.74 48.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.729 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 116' ' ' HIS . 51.7 mt -123.41 109.73 14.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.065 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.475 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 5.1 tt0 -72.62 143.38 48.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.423 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.636 179.254 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 . . . . . 0 CA--C 1.522 -0.133 0 CA-C-O 120.783 0.325 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.661 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.8 m95 -103.91 140.93 37.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.305 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.43 141.8 6.22 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.901 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.5 Cg_endo -66.42 169.11 14.68 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.367 2.044 . . . . 0.0 111.896 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.604 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 51.7 Cg_exo -51.69 103.98 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.594 2.196 . . . . 0.0 112.644 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.61 124.05 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.967 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.406 ' CA ' ' HB3' ' A' ' 63' ' ' ALA . . . -111.26 169.68 13.39 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.322 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -118.25 104.84 11.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.702 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.652 ' N ' HG22 ' A' ' 59' ' ' THR . 1.5 p -76.56 129.29 37.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.425 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.639 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -91.48 177.36 2.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.408 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.639 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.5 Cg_exo -57.34 -54.2 3.81 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.402 2.068 . . . . 0.0 112.87 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.23 3.73 86.56 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.373 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 21.6 tt0 -84.43 171.24 12.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.901 0.35 . . . . 0.0 110.736 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.87 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.7 t70 -97.06 157.73 15.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.273 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.512 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 12.9 m-20 -70.04 -64.92 0.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.281 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.576 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 22.7 tp -62.79 -42.93 99.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.113 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.87 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -49.35 -43.08 43.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.543 -179.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.652 HG22 ' N ' ' A' ' 50' ' ' VAL . 25.9 m -58.56 -45.26 89.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.412 ' HA ' ' O ' ' A' ' 11' ' ' CYS . . . -69.04 -30.04 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.823 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 88.4 mt -72.93 -51.85 16.91 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.118 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -41.71 95.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.802 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HB3' ' CA ' ' A' ' 48' ' ' GLY . . . -61.39 -39.57 91.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.173 0.511 . . . . 0.0 109.826 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.604 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 87.5 m -58.18 -47.03 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.891 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.46 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 13.2 pt20 -80.0 -25.15 40.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.978 0.418 . . . . 0.0 110.484 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -30.06 50.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.718 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.571 ' O ' HD23 ' A' ' 112' ' ' LEU . 69.2 mm-40 -107.68 -27.07 10.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.772 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.448 ' HB2' HD23 ' A' ' 32' ' ' LEU . . . -121.8 -7.93 8.98 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.834 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 79.49 -8.87 45.33 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 119.712 -1.232 . . . . 0.0 112.77 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.584 ' O ' HG23 ' A' ' 64' ' ' THR . 2.6 mt -93.82 132.71 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 120.866 0.365 . . . . 0.0 110.468 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pt-20 -116.52 170.18 8.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.21 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.509 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.5 -39.53 10.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.47 -21.66 68.89 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.435 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.443 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 7.1 tp60 -100.66 -3.39 30.42 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 103' ' ' VAL . 0.0 OUTLIER -133.03 -170.9 2.55 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 178.211 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.553 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 57.4 m -136.36 98.18 3.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 111.617 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.521 HD11 ' CD2' ' A' ' 61' ' ' LEU . 5.7 mm -69.28 127.89 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.137 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.407 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -92.43 137.76 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -97.98 151.3 20.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.126 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.11 -31.22 8.9 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.975 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.474 ' CD1' HD23 ' A' ' 100' ' ' LEU . 10.3 t80 -103.64 105.17 15.32 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 120.894 0.378 . . . . 0.0 110.72 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -135.68 122.35 20.94 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.339 0.59 . . . . 0.0 110.639 179.589 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -140.9 148.33 40.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.917 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.702 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 3.8 pm0 -133.06 125.36 29.45 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.431 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.451 HD13 ' HE2' ' A' ' 98' ' ' TYR . 7.2 mt -91.95 116.68 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.046 179.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.459 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.81 129.92 56.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.829 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -166.75 141.76 4.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.667 ' O ' HG11 ' A' ' 88' ' ' VAL . 7.7 p -81.99 111.42 18.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.847 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.48 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.887 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -37.47 18.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.066 0.46 . . . . 0.0 110.932 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 177.64 26.44 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.534 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.591 ' HB3' HD12 ' A' ' 8' ' ' LEU . 2.7 tptt -155.11 120.85 2.62 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.578 ' HG2' ' HB1' ' A' ' 7' ' ' ALA . 43.4 Cg_endo -68.73 117.84 5.27 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.372 2.715 . . . . 0.0 113.053 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.527 ' CD ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -100.58 115.46 30.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.985 -179.356 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.509 HG23 ' HB2' ' A' ' 84' ' ' GLU . 48.0 m -86.28 120.75 27.97 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.702 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.2 t -116.67 108.12 24.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.014 -0.275 . . . . 0.0 111.692 -178.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -84.52 125.63 40.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.524 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.4 m-85 -113.15 130.75 56.1 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.144 -177.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.561 ' CD2' HD12 ' A' ' 57' ' ' LEU . 3.7 m-90 -114.9 156.86 24.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.698 178.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.474 HD23 ' CD1' ' A' ' 81' ' ' PHE . 2.1 mt -93.18 113.13 25.28 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.553 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -124.81 148.94 47.9 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.966 0.412 . . . . 0.0 111.788 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.597 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.2 OUTLIER -123.38 117.94 26.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.129 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.532 ' HA ' ' HA ' ' A' ' 75' ' ' LEU . 7.6 m -71.94 132.61 33.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.853 0.358 . . . . 0.0 110.367 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.85 -20.68 66.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.702 -178.283 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.707 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 60.3 t0 -111.89 120.57 42.38 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.486 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 8.1 t80 -58.98 -38.12 78.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.353 178.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -105.69 26.1 9.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.996 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.707 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.6 p -43.3 149.02 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.456 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.553 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -70.21 142.93 52.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.222 0.535 . . . . 0.0 111.298 -179.099 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.618 HG13 ' CE2' ' A' ' 119' ' ' TYR . 46.1 mm -120.15 99.67 7.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.758 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.834 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 3.9 mtp180 -98.77 100.4 11.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.913 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 67' ' ' GLU . 14.0 mt -90.3 153.7 20.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.43 ' HG ' ' HE2' ' A' ' 67' ' ' GLU . 0.6 OUTLIER -113.77 -166.84 1.13 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.501 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.0 m80 -68.21 -1.45 6.16 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.557 ' HB2' ' HE2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -91.37 -27.65 18.21 Favored 'General case' 0 C--N 1.335 -0.051 0 CA-C-O 120.838 0.351 . . . . 0.0 110.722 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.519 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 23.5 m80 -127.15 141.38 51.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.689 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -100.58 -17.64 16.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.082 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.44 169.44 13.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.971 0.415 . . . . 0.0 111.515 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.618 ' CE2' HG13 ' A' ' 110' ' ' ILE . 35.9 p90 -140.42 174.96 10.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.112 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.56 163.07 33.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.313 0.578 . . . . 0.0 111.682 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.471 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 72.4 m95 -128.83 107.67 9.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.047 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.535 HD22 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -142.43 166.68 24.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.18 0.514 . . . . 0.0 111.819 -178.185 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.32 -151.34 1.72 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.313 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.1 tp -76.98 -47.19 21.47 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.923 0.392 . . . . 0.0 111.19 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -56.88 -51.79 67.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.787 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.78 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.96 -48.93 61.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.949 0.404 . . . . 0.0 110.787 -179.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.438 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.66 -29.24 52.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.323 0.582 . . . . 0.0 109.926 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.1 m -84.46 -32.58 23.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.407 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.78 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.64 -43.56 84.31 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.808 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.661 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.1 mt -77.42 -42.91 34.38 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.2 51.86 1.24 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.93 -29.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.707 -179.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.465 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 13.7 m-85 -60.47 119.84 8.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.327 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.48 -48.37 19.1 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.876 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.465 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 34.0 mp0 -48.16 -54.58 12.89 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.666 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.515 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -65.13 -42.17 94.13 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.33 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.61 -39.32 61.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.059 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.28 -46.75 60.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.771 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.477 ' HB1' HD12 ' A' ' 14' ' ' ILE . . . -51.4 -49.76 60.95 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.665 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -32.02 64.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.953 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.515 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -59.66 -52.29 66.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.248 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.401 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 3.0 mt-10 -71.55 -27.48 63.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.949 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.98 -42.73 92.97 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.894 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -76.27 -36.58 58.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.016 0.436 . . . . 0.0 110.22 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -63.48 -52.6 60.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.05 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -65.33 -51.95 57.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.463 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.591 HD11 ' CE2' ' A' ' 16' ' ' PHE . 75.5 mt -56.96 -25.16 57.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.886 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.4 t -78.39 -18.64 54.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.747 0.308 . . . . 0.0 110.611 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.697 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB1' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.109 0.481 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.702 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.24 139.42 44.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.208 179.2 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.5 ' HB3' HG11 ' A' ' 50' ' ' VAL . 2.5 mtt180 -82.8 125.02 30.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.366 -179.508 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -137.64 165.93 25.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.991 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.452 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 9.6 m -160.59 123.82 3.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.298 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.02 172.3 14.16 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.72 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.559 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -125.46 117.92 24.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -179.432 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.688 HG13 ' HB3' ' A' ' 98' ' ' TYR . 43.2 mt -83.74 92.02 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.632 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 18.2 mt -82.45 146.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.982 -178.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.727 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 53.7 p90 -152.24 121.41 6.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.278 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 2.5 ptm180 -82.16 114.69 20.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.224 0.535 . . . . 0.0 110.25 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttp85 . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.248 -179.085 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.07 0 CA-C-O 120.819 0.342 . . . . 0.0 111.404 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.727 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.2 mt -107.64 143.87 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 111.905 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.605 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -132.79 126.84 33.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.104 179.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.632 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.3 m-85 -89.71 151.68 21.73 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 47.8 tp -86.72 133.99 33.63 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.0 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.555 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.3 mt -135.23 144.33 46.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 67' ' ' GLU . 14.4 mt -123.61 113.24 18.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.086 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.494 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.5 tt0 -74.1 140.48 45.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.209 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.505 179.19 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.68 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 46.6 m95 -98.71 140.79 32.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.67 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.41 ' HB ' ' HZ1' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -163.27 142.59 6.66 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 -179.718 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 175.95 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.383 2.055 . . . . 0.0 112.105 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.683 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 6.8 Cg_exo -73.3 102.4 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.851 2.367 . . . . 0.0 112.428 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.545 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.7 OUTLIER -110.36 157.59 19.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.393 179.435 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -148.84 173.01 28.89 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.5 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 26.1 t-80 -99.29 110.53 23.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.529 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.5 p -76.92 134.6 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.729 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 8.6 tt0 -90.63 150.99 43.45 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.239 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.729 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.5 -21.82 19.78 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.861 2.374 . . . . 0.0 113.033 -178.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.629 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.64 -9.75 42.71 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.337 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -89.64 171.49 9.64 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.607 0.241 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.896 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.9 t70 -87.84 160.98 17.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.046 0.45 . . . . 0.0 110.651 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.553 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 16.7 m-20 -71.52 -58.99 3.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.146 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD11 ' CD2' ' A' ' 99' ' ' TRP . 23.0 tp -65.97 -42.13 90.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.211 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.896 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.82 -42.54 47.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.7 0.286 . . . . 0.0 110.503 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.529 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 98.5 m -60.48 -44.08 96.3 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.35 67.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.879 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 89.8 mt -71.83 -51.98 19.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.354 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -60.61 -42.35 96.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.593 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.178 0.513 . . . . 0.0 109.779 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.57 HG22 ' CD1' ' A' ' 15' ' ' ILE . 66.5 m -59.14 -53.64 56.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.301 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.523 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.7 pt20 -72.6 -20.94 61.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.028 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -77.96 -40.25 39.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.683 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 59.1 mm-40 -111.34 12.8 21.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.346 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.54 -11.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.591 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.05 2.41 46.86 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.291 -0.957 . . . . 0.0 113.123 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.602 ' CG2' HD22 ' A' ' 75' ' ' LEU . 1.5 mt -105.47 129.65 58.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.815 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.8 pm0 -110.17 172.38 6.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.648 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.502 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.27 -36.26 20.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.15 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.68 -18.96 72.65 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.062 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.501 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 4.7 mt-30 -100.76 -5.02 26.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.546 0.213 . . . . 0.0 111.28 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.733 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -132.75 -170.15 2.39 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.417 177.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -133.54 100.37 4.78 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.049 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.521 HD11 HD21 ' A' ' 61' ' ' LEU . 17.7 mm -74.39 123.38 29.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.242 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.582 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -83.32 139.06 18.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -97.88 144.98 26.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.173 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.2 -23.52 31.72 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.884 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.536 ' CD1' HD22 ' A' ' 100' ' ' LEU . 11.0 t80 -103.44 128.55 50.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.155 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.488 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -157.98 130.98 7.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.265 179.485 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -151.99 137.27 17.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.913 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.745 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -120.52 134.07 55.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.134 0.492 . . . . 0.0 112.04 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.702 HD11 ' HE2' ' A' ' 98' ' ' TYR . 7.9 mt -96.32 121.19 37.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -111.68 123.71 50.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -166.95 141.58 3.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.646 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.5 p -83.6 112.69 21.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.689 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.7 -97.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.674 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -74.05 -36.29 64.36 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.777 0.322 . . . . 0.0 110.943 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.7 t-20 178.98 24.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.218 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.567 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.6 tptt -155.32 126.95 3.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 110.891 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.619 ' HG2' ' HB1' ' A' ' 7' ' ' ALA . 56.3 Cg_endo -69.5 119.89 6.79 Favored 'Trans proline' 0 CA--C 1.515 -0.438 0 C-N-CA 123.437 2.758 . . . . 0.0 112.876 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.702 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 6.9 mmmt -101.51 129.39 47.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.04 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 m -95.49 114.62 26.4 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.745 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.4 t -113.75 107.76 23.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.653 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.37 120.33 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.702 ' HE2' HD11 ' A' ' 85' ' ' LEU . 8.5 m-85 -104.17 128.53 51.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.042 0.448 . . . . 0.0 111.705 -178.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CD2' HD11 ' A' ' 57' ' ' LEU . 7.9 m-90 -114.4 152.8 30.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.437 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.536 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 1.1 mt -88.59 121.37 30.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.509 ' HB3' HD21 ' A' ' 13' ' ' LEU . . . -130.8 144.71 51.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.549 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.9 tt0 -122.83 113.85 19.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.387 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.733 HG13 HD23 ' A' ' 75' ' ' LEU . 17.4 m -72.78 115.45 13.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 121.399 0.619 . . . . 0.0 110.869 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -60.24 -26.74 66.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.662 -178.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.886 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 2.1 m-20 -93.8 110.1 21.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.19 0.519 . . . . 0.0 111.501 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -58.38 -38.49 77.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.09 26.13 9.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.807 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.886 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.9 p -47.85 149.45 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.419 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.4 ' HE2' HE22 ' A' ' 74' ' ' GLN . 3.7 pm0 -73.39 142.31 46.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.134 0.493 . . . . 0.0 110.786 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.692 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.9 mm -118.27 99.65 8.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.591 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.1 OUTLIER -103.2 97.96 7.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.127 -179.457 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 5.5 mt -84.71 -177.75 6.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.775 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.44 -166.14 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.677 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -68.58 -14.99 63.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.685 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.61 23.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.687 0.279 . . . . 0.0 111.405 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.5 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 84.0 m-70 -119.76 122.08 40.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.899 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -103.75 -7.67 20.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.601 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -165.7 154.78 11.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.047 0.451 . . . . 0.0 111.24 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.692 ' CE2' HG13 ' A' ' 110' ' ' ILE . 43.6 p90 -134.45 171.61 14.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.493 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -157.78 157.82 34.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.211 0.529 . . . . 0.0 111.506 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.564 ' C ' ' HG2' ' A' ' 30' ' ' GLU . 73.3 m95 -122.47 109.55 14.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.521 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.61 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -138.94 170.67 15.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.007 0.432 . . . . 0.0 111.458 -178.651 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -75.43 -155.13 4.95 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.075 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 141' ' ' GLN . 7.2 tp -75.17 -41.23 58.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.652 0.263 . . . . 0.0 111.084 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.3 -51.24 68.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.37 -45.54 65.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.0 0.428 . . . . 0.0 110.479 -179.525 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -57.73 -29.98 65.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.238 0.542 . . . . 0.0 109.692 178.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 4.2 m -83.91 -32.1 25.3 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.32 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.586 ' NE2' ' HG ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -64.59 -44.27 91.16 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.68 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -77.13 -43.98 32.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.923 179.119 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.27 53.61 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.425 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.91 -30.57 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.571 -179.203 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.513 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 12.1 m-85 -60.28 118.49 6.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.426 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.447 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 8.7 tttt -46.4 -46.62 18.69 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.237 0.541 . . . . 0.0 111.693 -179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.544 ' HB3' ' CD1' ' A' ' 85' ' ' LEU . 14.9 mp0 -50.84 -54.46 23.58 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.981 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.489 ' HE2' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.19 -42.62 99.46 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.136 -179.55 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.447 ' HZ2' ' HA ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -51.76 -34.7 40.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 110.148 179.547 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.518 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.75 -47.45 25.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.939 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.419 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.94 -41.73 62.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.088 0.47 . . . . 0.0 110.207 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.69 -28.18 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.08 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.518 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.36 -52.02 51.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.05 -32.77 69.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.483 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.454 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.07 -39.78 90.29 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.215 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.4 -31.25 37.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.863 0.363 . . . . 0.0 110.588 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.54 -52.55 57.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.366 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.01 -53.55 48.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.927 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.582 ' CD2' HG12 ' A' ' 78' ' ' ILE . 86.8 mt -55.35 -39.79 70.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.921 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.5 t -60.75 -15.64 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.713 0.292 . . . . 0.0 110.888 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.45 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.671 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.089 0.471 . . . . 0.0 111.646 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.611 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -107.75 130.4 54.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.602 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.07 111.95 19.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.864 179.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.55 ' HB2' ' HG3' ' A' ' 94' ' ' LYS . . . -124.71 173.45 8.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.887 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.495 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 6.5 m -161.73 124.06 2.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.14 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.454 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -115.06 170.67 13.34 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -122.72 117.95 26.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.478 0.639 . . . . 0.0 111.687 -179.438 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.662 HG13 ' HB3' ' A' ' 98' ' ' TYR . 65.1 mt -82.24 91.17 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.638 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 177.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.639 HD12 HD23 ' A' ' 32' ' ' LEU . 19.6 mt -79.57 143.23 12.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.833 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.716 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 32.7 p90 -148.5 122.26 9.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.277 -178.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.587 ' HG2' HG21 ' A' ' 103' ' ' VAL . 63.2 mtm180 -80.79 114.2 19.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.81 -178.594 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.718 0.294 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.716 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.3 mt -102.27 151.13 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.411 0.624 . . . . 0.0 112.377 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.637 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 41.8 mt-10 -135.33 139.69 44.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.422 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.9 m-85 -101.36 152.42 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.639 HD23 HD12 ' A' ' 15' ' ' ILE . 23.6 tp -85.17 138.59 32.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.931 179.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.616 HD21 ' HB3' ' A' ' 43' ' ' TRP . 7.3 mt -138.37 136.22 36.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.502 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.633 HD11 ' O ' ' A' ' 67' ' ' GLU . 13.6 mt -113.84 113.04 24.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.635 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 6.2 tp60 -66.12 126.6 29.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 110.868 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.049 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.498 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 6.9 p-80 . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.635 ' CH2' ' HB2' ' A' ' 35' ' ' GLN . 77.0 m95 -112.81 120.31 41.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.532 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.599 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.9 OUTLIER -145.32 130.91 9.39 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.49 175.95 0.48 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.075 1.85 . . . . 0.0 111.594 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.705 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.8 Cg_exo -57.78 105.02 0.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.501 2.134 . . . . 0.0 112.78 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.599 ' HE3' ' HB ' ' A' ' 44' ' ' THR . 8.9 mtmp? -101.22 144.73 29.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.704 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -122.82 -162.67 11.6 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.564 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.54 96.0 3.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.94 0.4 . . . . 0.0 110.642 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.602 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 2.1 p -77.88 132.85 31.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.828 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.563 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -96.98 179.17 1.16 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.107 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.563 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.1 Cg_exo -57.01 -59.06 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.145 1.897 . . . . 0.0 112.593 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.65 2.29 87.55 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.47 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.456 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 9.7 tt0 -80.21 174.01 12.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.789 0.328 . . . . 0.0 110.6 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.846 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.7 t70 -94.39 153.77 17.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.216 0.532 . . . . 0.0 110.432 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.587 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -72.14 -63.37 1.15 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.286 -179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.543 ' HG ' HD11 ' A' ' 61' ' ' LEU . 20.7 tp -63.97 -39.54 94.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.618 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.846 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.76 -49.93 56.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.666 0.27 . . . . 0.0 110.745 -179.782 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.495 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 55.5 m -54.03 -40.8 67.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.73 61.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.647 HD23 HD12 ' A' ' 77' ' ' ILE . 90.1 mt -74.94 -53.49 8.91 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.75 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -59.81 -38.22 81.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.419 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.11 82.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.023 0.44 . . . . 0.0 109.962 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.705 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 14.0 m -60.13 -55.91 28.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.597 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.556 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -70.16 -22.11 63.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.868 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -79.06 -40.19 31.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.897 0.38 . . . . 0.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.633 ' O ' HD11 ' A' ' 34' ' ' LEU . 96.1 mt-10 -109.91 11.24 24.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.44 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -155.47 -6.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.51 0.31 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.819 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.556 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.7 mt -103.06 121.14 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 117.049 0.425 . . . . 0.0 110.48 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.4 pt-20 -108.66 173.27 6.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.082 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.553 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.97 -37.58 32.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.381 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.36 -16.14 73.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.153 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.837 HE21 ' HE2' ' A' ' 109' ' ' GLU . 1.6 tp60 -102.49 -4.41 25.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.524 0.202 . . . . 0.0 111.261 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.64 HD21 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -134.39 -174.07 3.46 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.857 0.36 . . . . 0.0 110.219 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.496 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 51.4 m -130.48 100.96 5.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.29 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.704 HD11 ' HB3' ' A' ' 101' ' ' ALA . 14.7 mm -74.1 129.34 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.397 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.505 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -92.27 139.58 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.528 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -98.74 151.41 20.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.0 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -26.42 24.15 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.453 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.583 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 11.1 t80 -104.3 127.35 51.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.017 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.46 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.4 ttpt -158.12 125.7 5.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.154 0.502 . . . . 0.0 111.662 179.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 139.91 25.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.551 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.707 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.7 OUTLIER -120.96 132.84 55.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.921 0.391 . . . . 0.0 111.429 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.491 HD13 ' C ' ' A' ' 135' ' ' GLU . 7.8 mt -98.25 116.93 31.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.615 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.5 m-80 -107.22 125.38 51.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.378 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -167.37 143.18 4.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.092 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.55 ' O ' HG13 ' A' ' 88' ' ' VAL . 8.3 p -83.66 106.45 14.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.626 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.23 -101.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.837 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 6.0 ptt180 -57.16 -41.41 79.15 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 6.6 p-10 172.55 29.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.376 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.611 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -157.73 128.96 3.75 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.292 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.671 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 40.8 Cg_endo -66.86 121.33 8.52 Favored 'Trans proline' 0 CA--C 1.514 -0.48 0 C-N-CA 123.287 2.658 . . . . 0.0 112.525 -179.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.55 ' HG3' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -104.92 123.65 48.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.895 -178.63 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 97.4 m -91.24 106.31 18.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.707 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.6 t -108.5 108.46 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.657 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.58 127.54 40.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.662 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.0 m-85 -115.35 130.0 56.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.587 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 15.0 m-90 -111.09 169.65 8.63 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.134 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.493 HD11 ' HG ' ' A' ' 147' ' ' LEU . 1.1 mt -102.95 112.32 25.09 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.704 ' HB3' HD11 ' A' ' 77' ' ' ILE . . . -121.34 151.2 40.38 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.53 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tt0 -125.88 112.24 15.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.414 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.64 HG12 HD21 ' A' ' 75' ' ' LEU . 5.0 m -72.07 112.92 8.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.548 0.69 . . . . 0.0 110.79 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 2.0 ptpt -58.01 -27.16 63.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.225 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.845 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 16.2 m-20 -94.32 111.06 22.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.203 0.525 . . . . 0.0 111.593 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.454 ' CE1' ' NH1' ' A' ' 17' ' ' ARG . 17.0 t80 -57.67 -39.99 78.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.422 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -103.86 27.34 7.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.715 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.845 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -46.9 151.53 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.749 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.837 ' HE2' HE21 ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.8 144.75 38.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.294 0.568 . . . . 0.0 111.231 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.652 ' CG2' HD23 ' A' ' 112' ' ' LEU . 44.9 mm -121.63 99.3 6.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.967 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.661 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -98.77 101.83 13.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.926 -178.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.652 HD23 ' CG2' ' A' ' 110' ' ' ILE . 14.4 mt -95.94 140.41 30.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.73 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.7 p -83.08 -164.94 0.95 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.414 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -72.86 -4.53 32.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.501 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -91.47 -22.89 20.18 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.603 0.239 . . . . 0.0 111.426 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 94.2 m-70 -120.84 129.36 53.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.017 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -98.74 -12.53 20.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.573 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.39 173.73 6.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.418 . . . . 0.0 111.436 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.587 ' CE2' HG13 ' A' ' 110' ' ' ILE . 46.8 p90 -146.68 174.64 11.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.578 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.472 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 49.7 mtt180 -156.12 153.6 29.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 111.745 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.55 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 95.2 m95 -119.02 107.67 13.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.276 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.532 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -138.2 167.42 21.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 111.51 -178.654 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.67 -152.6 3.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.1 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 141' ' ' GLN . 8.4 tp -77.25 -43.42 33.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.684 0.278 . . . . 0.0 111.292 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.2 pt-20 -59.91 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.665 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.851 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.28 -43.76 60.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.055 -179.434 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.36 -29.82 67.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.361 0.601 . . . . 0.0 109.747 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.7 m -84.84 -33.71 22.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.49 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.851 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.67 -43.51 84.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.581 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -75.27 -45.73 38.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.43 54.44 2.04 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.105 0.479 . . . . 0.0 109.865 178.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.0 -33.59 0.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.566 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.519 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 4.4 m-85 -54.2 119.52 5.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.108 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -45.98 -47.72 16.61 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.302 0.572 . . . . 0.0 111.354 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.519 ' OE2' ' HB3' ' A' ' 133' ' ' PHE . 26.0 mp0 -49.66 -57.14 7.77 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.911 -179.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.438 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.14 -46.86 87.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.398 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.02 -41.36 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.169 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.496 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.97 -47.38 65.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.411 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.573 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -52.15 -41.98 63.01 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.38 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.65 -28.19 33.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.119 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.63 -52.56 43.76 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.22 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.583 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -74.47 -25.37 59.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 -179.769 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.517 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.53 -47.64 88.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.472 -0.871 . . . . 0.0 111.771 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.411 ' CD2' HD12 ' A' ' 29' ' ' ILE . 5.9 t-160 -76.08 -29.67 58.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.962 0.41 . . . . 0.0 110.655 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -68.95 -52.81 25.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -61.52 -47.57 85.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.856 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.64 HD12 ' CE2' ' A' ' 16' ' ' PHE . 65.0 mt -54.29 -44.48 71.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.593 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.6 -11.99 59.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.926 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.439 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.633 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.222 0 CA-C-O 121.251 0.548 . . . . 0.0 111.362 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.654 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -111.09 138.66 47.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.01 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -84.25 112.84 20.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.578 179.432 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -124.71 170.73 10.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.258 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.9 m -163.16 124.48 2.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.087 0.47 . . . . 0.0 111.115 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.425 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.52 177.61 16.5 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.583 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.475 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -131.2 118.12 19.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.028 0.414 . . . . 0.0 111.762 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.714 HG13 ' HB3' ' A' ' 98' ' ' TYR . 65.4 mt -82.73 92.08 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.613 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 32.7 mt -83.73 145.16 8.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.444 -177.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.731 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.2 122.47 7.21 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.284 -179.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.615 ' HG2' HG23 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -80.65 112.94 18.49 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.124 179.19 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.436 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.781 0.324 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.731 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -115.12 146.44 19.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.239 0.542 . . . . 0.0 112.149 -179.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 20.5 mt-10 -136.35 129.68 31.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.926 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 63.7 m-85 -91.64 150.01 21.36 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.509 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.1 tp -84.82 133.73 34.32 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.506 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -134.98 141.18 46.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.639 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.412 ' HB2' ' CD2' ' A' ' 116' ' ' HIS . 14.4 mt -119.09 121.47 39.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.184 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.464 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 39.4 tt0 -61.42 162.48 7.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.59 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.795 -179.949 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.914 0.387 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.692 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 40.8 m95 -101.66 119.79 39.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -139.59 141.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.797 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.94 166.48 2.99 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.516 2.144 . . . . 0.0 112.09 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.727 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 24.3 Cg_exo -63.33 82.67 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.751 2.301 . . . . 0.0 112.132 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.425 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 12.8 pttm -87.05 156.22 19.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.085 0.469 . . . . 0.0 111.335 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.23 -178.86 19.42 Favored Glycine 0 N--CA 1.45 -0.371 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.302 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.46 ' NE2' ' HB3' ' A' ' 8' ' ' LEU . 4.8 t-80 -108.49 118.69 37.43 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.563 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -93.06 134.79 29.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.256 0.55 . . . . 0.0 111.25 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.651 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 5.1 tt0 -93.52 152.06 40.63 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.878 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.552 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.5 Cg_endo -54.23 -22.04 24.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.644 2.23 . . . . 0.0 112.58 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.651 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.07 -14.35 36.56 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.795 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HB3' HG21 ' A' ' 50' ' ' VAL . 17.1 tt0 -83.06 168.15 17.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.66 0.267 . . . . 0.0 110.671 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.983 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 27.4 t70 -85.69 161.65 19.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.114 0.483 . . . . 0.0 110.747 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.502 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -72.05 -63.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 -179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 61' ' ' LEU . 22.7 tp -66.66 -39.4 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.962 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.983 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.3 tt0 -49.69 -46.76 50.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.503 HG21 ' N ' ' A' ' 50' ' ' VAL . 96.9 m -58.85 -47.59 84.33 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' A' ' 64' ' ' THR . . . -65.75 -29.81 70.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.085 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.7 HD23 ' HB1' ' A' ' 72' ' ' ALA . 87.8 mt -72.18 -53.53 12.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.948 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -64.02 -33.05 74.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.567 -179.85 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.95 -32.15 72.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.028 0.442 . . . . 0.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.727 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 23.1 m -60.46 -51.17 70.61 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.499 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.519 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -75.54 -20.6 58.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.07 179.673 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.3 tm-20 -78.32 -38.28 42.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.056 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 96.3 mt-10 -110.25 -0.66 17.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.8 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.564 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -141.37 -10.9 0.94 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.616 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 75.26 -4.51 40.3 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.111 -1.042 . . . . 0.0 113.088 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.54 HG22 ' HG2' ' A' ' 74' ' ' GLN . 4.5 mt -100.71 126.95 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.085 0.469 . . . . 0.0 111.278 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.0 pt-20 -109.96 170.44 8.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.786 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.7 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -46.98 -38.89 11.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.039 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.95 -22.77 70.69 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.247 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.54 ' HG2' HG22 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -98.67 -1.9 39.63 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.476 0.179 . . . . 0.0 111.244 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.631 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -136.95 -169.63 2.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.201 178.148 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.57 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 24.4 m -136.34 99.68 4.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.609 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.414 HG23 ' CD2' ' A' ' 57' ' ' LEU . 8.4 mm -72.01 123.57 26.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.968 0.413 . . . . 0.0 111.009 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.509 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.87 139.23 17.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.777 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -98.75 151.7 20.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.097 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.1 -23.75 33.48 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.06 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.547 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 7.4 t80 -108.88 127.24 53.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.409 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -159.01 127.79 5.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.214 0.53 . . . . 0.0 111.645 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.444 HH12 ' HG2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -153.81 141.52 20.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.851 179.099 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.686 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -121.86 132.53 54.62 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.178 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.483 ' HG ' ' CE1' ' A' ' 98' ' ' TYR . 10.7 mt -94.54 118.74 32.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.351 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -105.72 126.02 51.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -166.57 141.09 4.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.021 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.645 ' O ' HG11 ' A' ' 88' ' ' VAL . 7.2 p -80.72 113.33 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.878 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.19 -107.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.369 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -61.65 -42.35 98.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.964 0.411 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -176.69 26.83 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.808 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.654 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.48 128.18 4.15 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.633 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 58.6 Cg_endo -72.22 116.0 4.54 Favored 'Trans proline' 0 CA--C 1.506 -0.895 0 C-N-CA 123.173 2.582 . . . . 0.0 112.404 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.638 ' HD3' ' CG2' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -105.93 122.2 45.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.791 -179.205 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.9 m -79.47 120.27 23.64 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 9.5 t -115.0 108.72 26.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.815 -178.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.602 HG23 ' CH2' ' A' ' 99' ' ' TRP . 1.2 mm -86.42 133.59 29.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.714 ' HB3' HG13 ' A' ' 14' ' ' ILE . 77.6 m-85 -118.11 129.85 55.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.107 0.48 . . . . 0.0 111.743 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.602 ' CH2' HG23 ' A' ' 97' ' ' ILE . 10.6 m-90 -117.47 139.57 50.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.934 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.479 HD21 ' CE1' ' A' ' 81' ' ' PHE . 1.1 mt -76.58 116.17 17.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.57 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -126.94 146.37 50.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 110.681 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.568 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.1 tm-20 -122.77 116.93 24.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.551 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.631 HG13 HD23 ' A' ' 75' ' ' LEU . 12.9 m -73.12 120.65 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.371 0.605 . . . . 0.0 110.422 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -28.96 69.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.121 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.761 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 51.4 t0 -98.72 128.21 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.064 0.459 . . . . 0.0 111.978 -179.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.56 -42.24 61.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.436 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.592 ' CG ' ' HD2' ' A' ' 105' ' ' ASP . 1.8 p30 -91.25 19.7 5.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.483 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.761 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.4 p -47.69 143.58 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.927 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.48 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -66.35 142.55 57.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.468 0.652 . . . . 0.0 111.649 -178.994 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.647 HG13 ' CE2' ' A' ' 119' ' ' TYR . 40.1 mm -123.96 95.36 3.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.953 179.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.616 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 12.3 mtp180 -95.22 101.34 13.07 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.727 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.709 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 12.2 mt -95.42 151.88 18.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.86 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.3 m -81.38 -169.03 2.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.109 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.25 6.12 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.535 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -102.23 -32.11 10.23 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.612 0.244 . . . . 0.0 111.149 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.709 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.3 m80 -97.16 113.47 25.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.974 0.416 . . . . 0.0 111.078 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -76.19 -19.46 58.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.699 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.77 -177.12 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.0 111.94 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.647 ' CE2' HG13 ' A' ' 110' ' ' ILE . 36.3 p90 -151.01 162.73 40.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.992 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.692 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -150.67 141.64 22.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.266 0.555 . . . . 0.0 111.681 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.483 ' CH2' HG21 ' A' ' 103' ' ' VAL . 84.4 m95 -98.79 107.64 20.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.222 178.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.508 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -135.09 168.31 19.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.814 -177.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.446 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -76.5 -152.02 4.17 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.599 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 6.7 tp -77.0 -40.94 44.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.826 0.346 . . . . 0.0 111.044 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.0 -51.18 70.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.866 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.662 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.69 -32.97 66.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 0.0 110.703 -179.334 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.506 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -69.91 -29.69 66.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.357 0.599 . . . . 0.0 109.497 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.43 -31.36 24.66 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.429 178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.7 OUTLIER -66.64 -45.51 78.78 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.782 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.563 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.8 mt -74.09 -44.82 52.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.67 51.98 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.191 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.425 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.1 -28.35 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.67 -179.494 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.502 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -58.11 117.41 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.405 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.445 ' HA ' ' HZ1' ' A' ' 137' ' ' LYS . 1.2 tttm -46.06 -44.98 15.85 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 111.778 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.502 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 20.9 mp0 -53.47 -53.36 52.51 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.624 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.494 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.97 -49.64 75.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.746 0.308 . . . . 0.0 111.394 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.477 ' HB2' ' HZ1' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -48.65 -39.61 24.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.11 179.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.493 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.88 -46.45 57.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.069 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.577 ' HB1' HD13 ' A' ' 14' ' ' ILE . . . -53.7 -41.47 66.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.161 0.505 . . . . 0.0 109.972 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.47 -27.93 41.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.174 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.493 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.01 -52.6 40.51 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.568 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.547 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 2.4 mp0 -73.75 -25.48 60.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.572 -179.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.441 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -62.09 -43.12 99.59 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.378 -0.915 . . . . 0.0 111.108 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -79.75 -31.92 41.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.027 0.442 . . . . 0.0 109.995 178.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 13.6 tp60 -65.53 -50.88 63.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.743 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -63.16 -50.51 70.11 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.732 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.543 HD11 ' CE1' ' A' ' 16' ' ' PHE . 97.8 mt -55.67 -30.6 61.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.98 -18.83 60.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.691 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.422 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.67 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.141 0 CA-C-O 121.265 0.555 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.647 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -117.92 140.31 49.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.809 178.839 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.602 ' HB3' HG11 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -84.56 133.11 34.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.748 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -150.66 166.34 30.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.596 179.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.451 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 96.4 m -155.25 124.59 6.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.916 0.388 . . . . 0.0 111.515 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.597 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -112.06 172.59 14.89 Favored Glycine 0 N--CA 1.452 -0.292 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 178.736 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.528 HD21 ' HB2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -127.14 117.76 23.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.294 0.547 . . . . 0.0 111.487 -179.931 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.589 HG13 ' HB3' ' A' ' 98' ' ' TYR . 74.3 mt -84.03 91.53 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.038 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 10.3 mt -83.11 146.2 7.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.172 -178.501 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.742 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.6 p90 -151.82 122.95 7.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.961 -178.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.518 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.83 111.64 17.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.949 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.257 0 CA-C-O 120.716 0.293 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.742 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 11.2 mt -99.58 147.83 6.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.376 0.607 . . . . 0.0 111.866 -179.17 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.532 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.7 mt-10 -136.74 122.94 20.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.306 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.6 m-85 -87.39 141.91 28.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.934 -178.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.546 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 38.3 tp -79.97 133.61 36.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.435 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -136.65 137.0 39.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.538 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.6 mt -113.8 125.9 54.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.985 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.553 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 2.1 tt0 -57.82 168.61 0.88 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.394 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.126 -179.985 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.553 ' CE2' ' HG3' ' A' ' 35' ' ' GLN . 50.6 m95 -111.7 135.6 52.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.021 -179.915 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -160.95 147.72 11.79 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.671 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.415 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 23.8 Cg_endo -61.36 169.44 6.51 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.574 2.183 . . . . 0.0 112.202 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.46 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 63.6 Cg_endo -75.54 108.59 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.798 2.332 . . . . 0.0 112.388 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.597 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.0 pttp -106.36 141.15 38.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 111.295 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -110.83 -161.74 17.77 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.964 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -130.04 105.12 7.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -78.22 113.93 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 121.295 0.569 . . . . 0.0 110.976 -179.783 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.639 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -74.52 177.99 1.93 Allowed Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.578 -179.919 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.639 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.3 Cg_exo -56.84 -50.04 12.76 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.338 2.026 . . . . 0.0 112.771 -179.518 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -96.06 12.88 66.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.908 -179.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.491 ' HB3' HG22 ' A' ' 50' ' ' VAL . 35.2 tt0 -86.5 167.29 14.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 -179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.966 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.3 t70 -92.21 158.71 16.0 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.18 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.434 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 2.9 m-20 -73.08 -61.46 1.81 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.304 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.646 HD12 ' CD2' ' A' ' 99' ' ' TRP . 17.9 tp -63.2 -39.78 95.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 0.0 110.935 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.966 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.84 -50.78 44.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 110.862 -179.897 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.451 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 56.3 m -55.63 -41.49 73.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' A' ' 12' ' ' GLY . . . -72.25 -30.32 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.996 178.357 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 95.9 mt -72.76 -52.25 15.81 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.272 179.133 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.441 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.58 -40.65 95.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.811 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.31 -36.5 78.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.562 HG22 ' CD1' ' A' ' 15' ' ' ILE . 85.5 m -59.78 -58.07 10.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.855 179.299 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.544 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.7 pt20 -68.91 -21.8 64.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 22.5 mt-10 -79.03 -42.87 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.358 . . . . 0.0 110.958 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -103.79 1.78 32.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.742 -179.623 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -144.54 -5.87 0.73 Allowed 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -179.804 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 65' ' ' GLN . . . 68.7 -1.59 9.61 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.141 -1.028 . . . . 0.0 112.811 -179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.544 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.6 mt -103.06 125.07 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.308 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -111.38 173.55 6.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.741 -179.619 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.481 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.42 -38.27 28.54 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.629 179.402 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.71 -14.46 60.57 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.449 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -106.98 -15.44 14.7 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.821 0.311 . . . . 0.0 111.453 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.721 HD22 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -123.65 -175.13 3.14 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.939 0.399 . . . . 0.0 110.449 178.623 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.525 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 43.0 m -129.27 100.76 5.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.094 -179.58 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 13' ' ' LEU . 13.2 mm -72.82 115.09 13.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.762 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.464 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -75.91 136.01 25.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -93.76 151.61 19.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.338 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.24 -23.51 35.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.292 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.433 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.7 t80 -107.29 127.03 53.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.789 0.328 . . . . 0.0 111.174 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.6 ttpt -158.72 125.12 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 179.637 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.92 145.05 31.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.085 179.403 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.731 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -126.17 126.38 44.01 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.224 179.852 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.535 HD13 ' HE2' ' A' ' 98' ' ' TYR . 4.7 mt -90.68 120.06 31.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 1.9 m-80 -110.47 124.22 51.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 -179.499 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -166.87 137.85 3.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.966 0.412 . . . . 0.0 111.126 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.604 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.8 p -76.33 113.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.345 0.593 . . . . 0.0 110.889 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.82 -105.56 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.819 -178.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 1.6 ptt-85 -63.45 -35.92 82.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.978 0.418 . . . . 0.0 110.394 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 90' ' ' ARG . 9.6 t-20 176.28 27.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.969 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.497 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.27 128.04 3.87 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 0.0 110.981 -179.968 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.67 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 44.0 Cg_endo -70.18 118.69 5.83 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.422 2.748 . . . . 0.0 113.099 -179.226 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.647 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 6.2 mmmt -99.26 130.2 45.54 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.144 -179.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.8 m -95.6 107.16 19.33 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.731 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 44.8 t -107.13 108.0 24.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.789 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.5 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.13 128.71 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.519 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.589 ' HB3' HG13 ' A' ' 14' ' ' ILE . 10.6 m-85 -108.54 163.25 13.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.334 0.588 . . . . 0.0 111.439 -178.83 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CD2' HD12 ' A' ' 57' ' ' LEU . 2.8 m-90 -150.75 136.23 17.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.172 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.5 HD12 ' HG ' ' A' ' 147' ' ' LEU . 0.4 OUTLIER -76.97 114.6 15.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.11 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -125.86 151.46 46.82 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 120.749 0.309 . . . . 0.0 111.305 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -124.86 113.35 17.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.163 -179.598 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.721 HG12 HD22 ' A' ' 75' ' ' LEU . 10.5 m -71.92 122.83 25.06 Favored 'Isoleucine or valine' 0 C--N 1.338 0.07 0 CA-C-O 121.171 0.51 . . . . 0.0 110.323 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -65.26 -21.55 66.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.98 -178.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.797 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 5.9 m-20 -102.67 113.15 26.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.221 0.534 . . . . 0.0 111.624 -179.048 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -58.56 -38.33 77.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.237 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -103.24 23.3 12.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.548 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.797 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.1 p -42.99 148.83 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.826 -179.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.652 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 15.5 pm0 -73.22 141.76 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.273 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.681 HG22 ' CD1' ' A' ' 119' ' ' TYR . 36.6 mm -120.43 105.19 16.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.634 179.086 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.652 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -103.38 97.44 7.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.59 -179.241 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.431 HD21 HG21 ' A' ' 110' ' ' ILE . 3.3 mt -95.75 144.46 26.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.357 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 115' ' ' GLU . 2.7 p -94.06 -169.36 2.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.606 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . 0.407 ' H ' ' CD2' ' A' ' 114' ' ' HIS . 4.4 p80 -67.55 10.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.689 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.4 mt-10 -100.88 -30.48 11.65 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.72 0.295 . . . . 0.0 110.887 179.431 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -124.78 124.0 41.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.889 0.376 . . . . 0.0 110.942 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -17.57 44.77 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.5 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -163.46 -176.56 4.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.241 0.544 . . . . 0.0 111.507 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.681 ' CD1' HG22 ' A' ' 110' ' ' ILE . 31.9 p90 -153.59 172.38 17.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.325 -179.589 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -157.9 157.87 33.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.118 0.485 . . . . 0.0 111.03 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.546 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 83.5 m95 -122.31 107.06 11.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.382 178.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.43 ' CD1' ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -135.82 165.09 26.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 0.0 111.567 -178.402 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.53 -154.14 1.21 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.819 179.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.8 tp -76.73 -43.67 36.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.836 0.35 . . . . 0.0 110.745 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -57.36 -51.63 68.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.614 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.551 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.62 -53.08 20.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.811 0.338 . . . . 0.0 110.244 -179.887 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.435 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.04 -27.41 7.93 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.525 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.415 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.5 OUTLIER -82.69 -35.25 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.511 178.392 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.594 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -63.55 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.5 -179.642 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.594 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -77.91 -39.77 41.87 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.265 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.407 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -80.03 47.8 0.92 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 179.285 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.19 -29.34 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.726 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.445 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -59.69 119.83 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.421 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -46.46 -46.24 18.77 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.218 0.532 . . . . 0.0 111.847 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.464 ' HB3' ' CD1' ' A' ' 85' ' ' LEU . 23.1 mp0 -52.7 -56.39 15.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.893 -178.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.471 ' HE2' ' CE2' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -59.43 -41.0 88.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.571 0.224 . . . . 0.0 111.446 -179.347 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.59 -42.3 64.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.103 179.455 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.11 -47.62 67.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.608 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.495 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.34 -49.1 62.07 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.92 0.391 . . . . 0.0 110.206 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.36 -26.81 60.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.319 178.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.539 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.06 -52.72 32.07 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.095 -179.818 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.79 -29.17 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.264 179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.438 ' HA2' HD11 ' A' ' 100' ' ' LEU . . . -58.71 -48.46 84.83 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.854 179.379 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.444 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -74.55 -28.95 61.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.887 0.375 . . . . 0.0 110.743 179.579 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 8.1 tp60 -68.35 -51.46 44.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.481 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -65.43 -51.21 61.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.996 0.427 . . . . 0.0 110.953 -179.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.5 ' HG ' HD12 ' A' ' 100' ' ' LEU . 93.9 mt -56.33 -32.29 64.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.899 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 4.2 t -75.98 -14.03 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.0 110.714 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.784 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.534 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 121.204 0.526 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.723 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.18 131.26 56.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.354 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.529 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -82.89 132.39 35.16 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.673 -178.907 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.438 ' CB ' ' HE3' ' A' ' 94' ' ' LYS . . . -145.1 163.22 34.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.507 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.7 m -154.52 124.31 6.65 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.029 0.443 . . . . 0.0 111.732 -179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.407 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.26 171.49 13.87 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 178.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.548 HD13 ' CD1' ' A' ' 77' ' ' ILE . 0.9 OUTLIER -122.57 117.89 26.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.28 0.54 . . . . 0.0 112.44 -179.174 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.861 HD13 ' HB3' ' A' ' 139' ' ' ALA . 54.2 mt -80.73 92.12 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.781 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.287 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.672 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 27.2 mt -84.4 146.88 6.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.706 -178.035 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.765 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.6 p90 -153.88 121.15 5.76 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.288 -179.385 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.445 ' CG ' ' HB2' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -79.74 114.42 18.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.518 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.431 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.127 -179.112 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.765 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.7 mt -111.14 141.11 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.056 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.651 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.1 mt-10 -133.89 127.25 32.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.046 179.102 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.672 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -87.09 154.37 20.8 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.5 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.573 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 39.2 tp -90.73 135.01 33.99 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.843 178.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.477 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.9 mt -135.11 142.02 46.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.757 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.521 HD12 ' N ' ' A' ' 46' ' ' PRO . 14.5 mt -121.81 107.42 12.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.419 ' HB2' ' CD2' ' A' ' 43' ' ' TRP . 37.3 tt0 -67.71 141.77 56.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.191 179.964 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 120.849 0.357 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.604 ' CZ3' ' HB2' ' A' ' 120' ' ' ARG . 37.5 m95 -98.11 150.1 21.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.035 179.916 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -171.54 144.02 1.56 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.524 -179.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.446 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 32.8 Cg_exo -61.56 165.63 13.1 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.356 2.037 . . . . 0.0 112.171 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.521 ' N ' HD12 ' A' ' 34' ' ' LEU . 18.4 Cg_endo -61.12 102.07 0.2 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.484 2.123 . . . . 0.0 112.443 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -87.92 155.44 19.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.907 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -138.13 174.29 22.0 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.206 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -115.81 103.53 10.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.677 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.4 p -81.3 127.37 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.302 0.572 . . . . 0.0 111.363 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.607 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.0 tt0 -88.46 153.24 50.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.291 179.968 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 12.5 Cg_endo -55.57 -18.74 21.07 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.985 2.456 . . . . 0.0 112.585 -179.525 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.607 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -107.54 -6.67 32.99 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.926 179.213 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -88.75 176.48 7.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.891 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -92.7 161.41 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.029 0.442 . . . . 0.0 109.991 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.442 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 24.3 m-20 -73.7 -61.06 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.849 -179.099 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.646 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 36.6 tp -65.91 -40.01 91.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.74 0.305 . . . . 0.0 110.831 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.891 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.15 -47.15 54.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.79 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 50' ' ' VAL . 85.1 m -58.0 -43.6 86.72 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.94 -32.7 71.11 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.019 178.755 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.641 HD12 ' HG ' ' A' ' 57' ' ' LEU . 91.2 mt -71.11 -51.77 23.18 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.491 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.519 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.2 OUTLIER -61.78 -41.03 97.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.011 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.78 77.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.163 0.506 . . . . 0.0 110.24 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.596 HG22 ' CD1' ' A' ' 15' ' ' ILE . 93.5 m -60.08 -51.39 69.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.434 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.0 pt20 -76.85 -21.81 54.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.515 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.519 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -78.27 -35.03 48.59 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.304 . . . . 0.0 110.73 179.193 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.592 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 2.0 mp0 -108.18 -14.24 14.75 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.476 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -129.5 -8.79 4.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.691 0.281 . . . . 0.0 111.632 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.906 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.54 -8.65 25.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.236 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.682 HG22 ' HG2' ' A' ' 74' ' ' GLN . 3.2 mt -94.22 123.4 46.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.012 -179.677 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pm0 -103.54 169.38 8.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.023 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.588 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -45.89 -39.13 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.364 179.719 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.95 -23.02 74.32 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.382 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.682 ' HG2' HG22 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -95.76 1.39 53.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.726 0.298 . . . . 0.0 111.324 -179.994 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.799 HD21 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -137.69 -166.41 1.95 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.692 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -140.57 98.52 3.43 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.568 HG22 HD21 ' A' ' 57' ' ' LEU . 9.4 mm -73.24 114.2 12.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.074 0.464 . . . . 0.0 111.778 -179.848 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.475 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -77.05 138.13 21.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.62 179.322 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -97.52 148.82 22.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.403 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.93 -24.64 27.7 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.12 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.651 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 12.1 t80 -104.35 127.43 52.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.836 0.35 . . . . 0.0 111.146 -179.842 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.509 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -158.94 128.19 5.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.261 0.553 . . . . 0.0 111.31 179.577 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.4 tpt85 -154.53 137.86 15.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.95 179.294 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.707 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.9 pm0 -120.83 136.13 54.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.169 0.509 . . . . 0.0 111.455 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 135' ' ' GLU . 7.6 mt -95.24 118.21 31.61 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.168 179.163 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -108.34 126.3 52.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.735 -179.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -167.0 141.0 3.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 -179.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.701 ' O ' HG13 ' A' ' 88' ' ' VAL . 9.9 p -80.7 113.57 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.53 0.681 . . . . 0.0 110.64 179.294 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.61 -102.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.352 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.402 HH11 ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -77.48 -35.01 54.14 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 120.964 0.412 . . . . 0.0 110.312 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -172.89 16.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.603 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.585 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -148.6 126.38 5.76 Favored Pre-proline 0 N--CA 1.451 -0.384 0 CA-C-O 120.945 0.402 . . . . 0.0 111.365 -179.616 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.649 ' HA ' ' HA ' ' A' ' 88' ' ' VAL . 50.6 Cg_endo -69.06 118.71 5.84 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.615 2.877 . . . . 0.0 113.234 -179.52 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.723 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 4.6 mmmt -101.39 124.76 47.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.331 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -89.4 114.93 26.45 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.707 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 37.5 t -113.52 108.03 24.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.759 -178.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.545 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.35 132.5 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.707 ' HB3' HG13 ' A' ' 14' ' ' ILE . 43.0 m-85 -118.66 129.97 55.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.126 0.488 . . . . 0.0 111.656 -178.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 1.1 m-90 -118.47 142.62 47.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.387 179.47 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.615 HD21 ' CD1' ' A' ' 81' ' ' PHE . 1.5 mt -76.07 123.09 25.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.626 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -133.85 134.39 42.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.441 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.623 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.4 tt0 -114.78 115.15 26.56 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.182 -179.533 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.799 HG13 HD21 ' A' ' 75' ' ' LEU . 16.6 m -72.05 108.29 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-O 121.547 0.689 . . . . 0.0 110.143 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -57.07 -13.04 2.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.974 -178.774 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.696 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.2 t0 -107.87 116.6 32.24 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.012 0.434 . . . . 0.0 111.347 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -65.59 -38.96 90.99 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.323 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.39 25.74 6.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.511 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.696 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.1 p -51.37 146.33 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.834 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.1 pm0 -74.12 145.84 44.01 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.065 -179.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.708 HG13 ' CE2' ' A' ' 119' ' ' TYR . 32.7 mm -122.47 101.22 9.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.951 179.389 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.906 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -102.11 97.03 7.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.095 -179.468 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.592 ' HA ' ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -90.03 150.53 22.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.801 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.2 t -83.86 -168.13 2.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.09 1.58 10.79 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.552 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -98.83 -29.14 13.14 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.6 m80 -109.11 110.81 22.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.769 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -89.53 -6.73 56.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.842 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -170.61 152.62 3.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.107 0.48 . . . . 0.0 111.838 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.708 ' CE2' HG13 ' A' ' 110' ' ' ILE . 32.7 p90 -133.23 175.81 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.306 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.604 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -157.54 166.32 33.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.368 0.604 . . . . 0.0 111.798 179.801 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.455 ' CH2' HG23 ' A' ' 103' ' ' VAL . 83.5 m95 -131.01 106.75 8.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.335 178.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.647 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -137.38 170.17 16.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.205 0.526 . . . . 0.0 111.518 -178.441 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.434 ' O ' ' HB1' ' A' ' 127' ' ' ALA . . . -74.71 -153.26 3.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.706 179.437 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.437 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.5 tp -77.23 -41.26 41.9 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.989 0.423 . . . . 0.0 111.264 179.724 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.6 pt-20 -61.25 -50.93 71.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.488 -179.566 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -71.65 -40.57 69.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.403 -179.347 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.477 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -62.25 -32.42 73.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.8 m -82.19 -31.13 30.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.569 179.162 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 1.2 pp0? -67.23 -44.75 78.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.011 -179.64 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.647 ' CD1' HD13 ' A' ' 122' ' ' LEU . 1.8 mt -74.71 -46.19 39.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.417 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -77.66 51.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -26.99 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.88 -179.326 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.64 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.2 m-85 -61.03 119.43 8.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.413 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.89 -46.75 11.06 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.078 0.466 . . . . 0.0 111.87 -179.02 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.64 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 13.1 mp0 -52.46 -54.49 31.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.827 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.54 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.61 -41.37 98.94 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -178.595 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -55.77 -34.49 65.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.685 0.278 . . . . 0.0 110.344 179.729 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.481 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.79 -43.75 53.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.471 179.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.861 ' HB3' HD13 ' A' ' 14' ' ' ILE . . . -56.41 -45.54 80.62 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.302 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.58 -26.41 57.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.991 178.138 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.4 -52.06 37.15 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.31 0.576 . . . . 0.0 110.533 179.867 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.651 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 4.5 mm-40 -69.9 -28.99 66.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.861 -179.594 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.437 ' HA2' HD23 ' A' ' 100' ' ' LEU . . . -58.29 -47.98 86.33 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.313 179.589 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.514 ' NE2' HD13 ' A' ' 29' ' ' ILE . 0.9 OUTLIER -75.21 -33.08 61.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.984 0.421 . . . . 0.0 110.342 179.587 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . 0.409 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 4.4 tp60 -63.31 -51.88 64.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.716 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -61.93 -50.48 71.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.739 179.815 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.69 HD13 ' CZ ' ' A' ' 16' ' ' PHE . 69.9 mt -59.48 -34.11 72.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.1 t -74.02 -20.02 60.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.724 179.36 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.53 0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.937 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.667 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 121.381 0.61 . . . . 0.0 111.49 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.58 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -109.39 138.87 45.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.52 179.801 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.415 ' HB3' HG12 ' A' ' 50' ' ' VAL . 0.1 OUTLIER -79.11 128.52 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.984 -179.981 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.82 161.07 39.6 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.456 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 20.8 m -157.14 123.47 4.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.162 0.506 . . . . 0.0 111.212 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' A' ' 60' ' ' ALA . . . -117.49 170.85 13.66 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.483 178.79 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.405 HD21 ' HB2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -122.73 118.15 27.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.049 0.425 . . . . 0.0 111.669 -179.42 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.65 HG13 ' HB3' ' A' ' 98' ' ' TYR . 56.1 mt -83.01 91.22 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.432 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.128 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.613 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 29.6 mt -81.15 145.29 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.049 -178.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.703 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 46.2 p90 -151.91 121.19 6.77 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.016 -178.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.445 ' CD ' ' HA ' ' A' ' 106' ' ' TYR . 8.9 ttp180 -76.67 118.02 18.88 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.3 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.57 HH11 ' HB2' ' A' ' 18' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.946 -178.378 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.703 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.3 mt -107.61 154.9 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.114 0.483 . . . . 0.0 111.772 -179.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.5 mp0 -138.37 127.32 23.94 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.121 179.659 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.614 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 55.2 m-85 -91.35 146.68 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.955 0.407 . . . . 0.0 112.036 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 43.5 tp -81.88 132.68 35.28 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.652 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.462 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.5 mt -133.14 142.74 48.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.968 0.413 . . . . 0.0 110.791 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.2 mt -121.81 104.2 9.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.522 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 3.8 tt0 -64.56 134.07 53.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.271 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.366 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.599 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.563 ' HD1' ' H ' ' A' ' 42' ' ' HIS . 3.8 p-80 . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.586 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.6 m95 -104.59 137.9 41.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.296 -179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.5 136.68 6.23 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.985 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.02 178.78 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.405 2.07 . . . . 0.0 111.656 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 50.9 Cg_exo -56.31 98.12 0.07 OUTLIER 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.437 2.091 . . . . 0.0 112.644 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -97.97 129.31 44.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.773 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -146.47 140.74 8.97 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.701 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 5.8 p80 -76.29 127.23 32.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.663 0.268 . . . . 0.0 110.798 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.509 ' HB ' HG21 ' A' ' 59' ' ' THR . 0.9 OUTLIER -88.72 137.32 21.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.984 0.421 . . . . 0.0 110.582 179.634 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 3.0 tt0 -89.72 152.12 46.48 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.544 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.4 Cg_endo -55.25 -22.91 34.7 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.524 2.149 . . . . 0.0 112.971 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.632 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.42 -11.83 43.57 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.383 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -88.05 158.64 18.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.603 0.24 . . . . 0.0 110.63 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.885 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 16.8 t0 -77.73 163.42 26.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.995 0.426 . . . . 0.0 110.22 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.87 -61.37 1.79 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.577 HD13 ' CD2' ' A' ' 99' ' ' TRP . 22.0 tp -64.32 -41.7 96.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.145 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.885 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 2.1 mt-10 -51.19 -45.15 61.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.687 -179.545 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.509 HG21 ' HB ' ' A' ' 50' ' ' VAL . 82.4 m -58.21 -40.91 82.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.149 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' GLY . . . -72.49 -30.62 64.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.905 178.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.539 HD12 ' HG ' ' A' ' 57' ' ' LEU . 96.0 mt -72.62 -52.47 15.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.421 179.349 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.48 -41.02 96.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.804 -179.659 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 46' ' ' PRO . . . -60.45 -33.64 72.86 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.147 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.587 HG22 ' CD1' ' A' ' 15' ' ' ILE . 24.5 m -60.14 -58.26 9.28 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.412 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.471 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -70.18 -20.31 63.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.621 179.47 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.4 tm-20 -79.06 -39.86 32.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.125 179.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.43 ' O ' HD22 ' A' ' 112' ' ' LEU . 10.3 mm-40 -106.38 -5.3 19.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.934 -179.309 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -138.46 -11.76 1.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.525 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.653 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.38 -3.85 51.9 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.857 -1.164 . . . . 0.0 112.85 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.519 ' CG2' ' HB3' ' A' ' 74' ' ' GLN . 5.0 mt -99.01 121.79 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.535 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 pm0 -105.11 171.06 7.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.523 0.202 . . . . 0.0 111.208 -179.387 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.595 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -48.93 -31.7 7.78 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.698 179.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.89 -23.85 75.46 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.317 -0.944 . . . . 0.0 111.857 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.519 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 2.5 tp60 -95.03 3.85 54.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 0.0 110.921 179.655 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.67 HD22 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -141.48 -169.25 2.83 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.289 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.492 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -137.23 100.3 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.364 -179.671 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.66 HD11 ' HB3' ' A' ' 101' ' ' ALA . 10.1 mm -71.59 126.92 32.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.96 179.74 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.524 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -90.02 137.69 20.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.062 0.458 . . . . 0.0 111.07 -179.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -97.85 149.95 21.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.397 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.21 -27.1 21.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.352 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.556 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 15.0 t80 -105.03 126.02 51.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.733 0.301 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.57 124.56 5.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.257 0.551 . . . . 0.0 111.524 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.76 140.71 21.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.464 179.053 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.679 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 4.0 pm0 -121.19 138.26 54.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.05 0.452 . . . . 0.0 111.771 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.595 HD11 ' HE2' ' A' ' 98' ' ' TYR . 6.4 mt -98.87 116.91 32.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.622 179.457 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.1 p30 -113.86 125.66 54.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.5 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.1 p90 -166.67 146.25 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.572 -179.672 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 88' ' ' VAL . 9.9 p -82.37 110.71 17.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.332 179.561 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.78 -95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.627 -179.066 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.437 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -67.28 -41.17 85.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.872 0.368 . . . . 0.0 110.655 -179.923 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.477 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER 178.12 26.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.278 179.766 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.58 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.48 129.94 4.24 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.447 179.591 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.667 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 56.5 Cg_endo -70.07 119.58 6.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.208 2.605 . . . . 0.0 112.998 -179.195 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.547 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 7.4 mmmt -104.3 121.9 44.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.047 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.0 m -87.94 116.81 26.37 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.679 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.1 t -115.81 108.9 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.859 -178.114 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.618 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.6 mm -86.0 126.63 40.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.374 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.65 ' HB3' HG13 ' A' ' 14' ' ' ILE . 13.8 m-85 -113.27 133.25 55.2 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.085 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.577 ' CD2' HD13 ' A' ' 57' ' ' LEU . 9.3 m-90 -117.83 141.43 48.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.949 178.566 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.477 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -78.07 115.65 17.96 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.791 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.66 ' HB3' HD11 ' A' ' 77' ' ' ILE . . . -124.55 144.4 50.15 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.16 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.455 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.3 tt0 -123.1 116.38 23.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.81 0.338 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.67 HG13 HD22 ' A' ' 75' ' ' LEU . 11.2 m -73.22 115.01 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.431 0.634 . . . . 0.0 110.705 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.498 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.17 -11.95 17.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.607 -179.188 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.793 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 66.9 t0 -114.12 121.55 44.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.619 179.278 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.445 ' HA ' ' CD ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -70.59 -47.47 60.01 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.581 0.705 . . . . 0.0 109.456 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.542 ' CG ' ' HD2' ' A' ' 105' ' ' ASP . 4.1 p-10 -85.03 16.49 3.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.057 178.491 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.793 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.8 p -46.14 144.53 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.153 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.101 179.909 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.475 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.6 OUTLIER -66.82 143.95 56.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 111.755 -179.033 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.611 HG13 ' CE2' ' A' ' 119' ' ' TYR . 42.0 mm -123.45 99.8 7.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.81 -1.087 . . . . 0.0 110.222 179.37 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.653 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 23.8 mtp180 -102.13 103.08 13.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.332 -178.658 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 67' ' ' GLU . 11.3 mt -98.85 135.6 40.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -164.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.113 179.343 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 14.4 0.92 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 179.681 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.62 -36.15 7.58 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.843 0.354 . . . . 0.0 110.886 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.405 ' CD2' ' HB3' ' A' ' 67' ' ' GLU . 75.3 m-70 -113.31 115.68 28.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.607 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.93 -14.36 42.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.827 -179.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -160.05 153.11 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.07 0.462 . . . . 0.0 112.131 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.611 ' CE2' HG13 ' A' ' 110' ' ' ILE . 45.0 p90 -133.19 171.41 14.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.168 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.413 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 3.6 mtt180 -157.37 160.3 38.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.213 0.53 . . . . 0.0 111.846 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.467 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.2 m95 -124.21 107.67 11.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.791 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.534 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -139.47 168.49 19.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.942 -178.303 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . -73.73 -153.94 2.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.998 179.59 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 12.4 tp -77.33 -41.6 39.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.828 0.347 . . . . 0.0 111.119 -179.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.6 pt-20 -61.43 -50.23 73.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.619 -179.449 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.796 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.93 -45.8 63.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.87 0.366 . . . . 0.0 110.531 -179.47 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.462 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.89 -30.46 63.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 109.802 179.174 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.402 ' O ' ' HD2' ' A' ' 137' ' ' LYS . 9.7 m -84.38 -31.98 24.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.271 178.634 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.796 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.01 -43.79 91.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.872 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.638 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.1 mt -77.72 -42.55 33.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.954 179.281 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.2 53.5 1.24 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.439 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.19 -32.14 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 114.885 -1.052 . . . . 0.0 111.876 -178.932 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.541 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 40.9 m-85 -59.74 120.75 10.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.308 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -46.32 -52.27 13.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.301 0.572 . . . . 0.0 111.26 -179.453 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.541 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 15.9 mp0 -43.6 -54.39 4.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.829 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -34.06 77.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.872 0.368 . . . . 0.0 110.584 -179.498 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -59.91 -35.32 74.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.408 179.545 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.42 -45.29 22.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.794 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.622 ' HB3' HD12 ' A' ' 14' ' ' ILE . . . -52.84 -55.38 23.48 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.114 179.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.8 -27.56 69.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.455 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.49 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.99 -51.77 35.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.029 -179.9 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.556 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 71.1 mm-40 -71.26 -30.96 66.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . 0.425 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.32 -47.63 88.45 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.651 179.105 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 29.8 t-80 -74.58 -31.69 62.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.803 0.335 . . . . 0.0 110.435 179.192 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -64.68 -53.2 51.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.348 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.16 -48.9 78.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.747 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.627 HD11 ' CE1' ' A' ' 16' ' ' PHE . 79.3 mt -60.91 -26.99 67.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.532 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.7 t -76.04 -17.13 59.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.782 0.325 . . . . 0.0 110.792 179.443 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.333 -0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.598 -179.766 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.585 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.461 0.124 0 CA-C-O 121.062 0.458 . . . . 0.0 111.351 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.574 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -118.22 137.19 53.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.309 179.565 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.65 115.74 24.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.146 -179.665 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.596 ' HB3' ' HG2' ' A' ' 94' ' ' LYS . . . -126.84 174.59 8.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.531 ' HB2' HG22 ' A' ' 59' ' ' THR . 9.7 m -164.04 124.91 2.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.164 0.507 . . . . 0.0 111.186 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.542 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.94 175.88 15.9 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.519 HD22 ' O ' ' A' ' 99' ' ' TRP . 1.2 mt -128.99 119.4 24.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.466 0.633 . . . . 0.0 112.693 -178.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.549 ' CG1' ' HB3' ' A' ' 98' ' ' TYR . 14.2 mm -77.0 91.61 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.225 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.657 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 58.7 mt -88.01 141.83 13.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.601 -178.287 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.794 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 54.8 p90 -152.23 122.42 7.16 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -179.116 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 9.2 ptt85 -83.69 114.31 21.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.251 179.31 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.95 -179.546 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 121.028 0.442 . . . . 0.0 111.668 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.798 ' HB ' ' HE2' ' A' ' 144' ' ' HIS . 4.1 mt -106.29 143.54 17.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.113 -179.05 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.728 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.6 OUTLIER -137.28 132.94 34.43 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.244 179.45 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.657 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 45.0 m-85 -94.75 143.52 26.38 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.072 0.463 . . . . 0.0 112.233 -178.682 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.571 HD22 HD11 ' A' ' 15' ' ' ILE . 50.0 tp -79.59 132.87 36.39 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.339 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.545 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.7 mt -135.04 140.71 45.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.648 179.833 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.663 HD21 HD23 ' A' ' 112' ' ' LEU . 8.7 mt -117.86 123.79 46.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 -178.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.495 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 1.2 tt0 -68.59 151.71 46.36 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.135 -179.414 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.16 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.344 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 120.815 0.341 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.624 ' CD1' HD21 ' A' ' 130' ' ' LEU . 26.8 m95 -103.05 110.31 22.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.386 179.733 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.627 ' HB ' ' HE2' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -126.91 128.47 24.21 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.778 -179.323 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.536 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 49.2 Cg_exo -55.9 168.18 1.93 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.326 2.017 . . . . 0.0 112.493 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.653 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 15.2 Cg_endo -59.79 101.04 0.14 Allowed 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 123.148 2.565 . . . . 0.0 112.875 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HE2' ' HB ' ' A' ' 44' ' ' THR . 4.7 mtmt -103.52 129.57 50.73 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.852 0.358 . . . . 0.0 111.093 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -111.13 -179.37 20.25 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.345 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -120.02 104.84 10.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 110.69 179.692 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.694 ' N ' HG23 ' A' ' 59' ' ' THR . 1.6 p -76.2 129.04 37.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.042 0.449 . . . . 0.0 111.193 -179.138 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.646 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -92.4 177.01 2.28 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.539 -179.596 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.646 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.0 Cg_exo -57.42 -60.25 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.684 2.256 . . . . 0.0 112.72 -178.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.54 0.13 88.41 Favored Glycine 0 CA--C 1.517 0.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.694 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.603 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 17.6 tt0 -78.73 171.98 14.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.35 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.962 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.4 t70 -98.6 158.69 15.44 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.208 0.527 . . . . 0.0 110.056 178.896 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.551 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.755 -179.074 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.658 ' HG ' HD11 ' A' ' 61' ' ' LEU . 33.1 tp -65.2 -39.04 92.3 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.668 0.27 . . . . 0.0 111.223 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.962 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -49.1 -45.38 43.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.665 179.675 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.694 HG23 ' N ' ' A' ' 50' ' ' VAL . 66.6 m -59.83 -48.62 80.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.33 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.51 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -64.64 -28.02 69.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.158 178.694 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.658 HD11 ' HG ' ' A' ' 57' ' ' LEU . 93.2 mt -76.35 -51.67 11.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.25 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -63.08 -35.18 79.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' A' ' 66' ' ' GLU . . . -65.72 -38.23 88.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.609 HG22 ' O ' ' A' ' 70' ' ' ILE . 56.2 m -56.15 -51.21 68.8 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.593 179.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.459 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.2 pt20 -76.03 -21.97 56.26 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.961 179.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 0.9 OUTLIER -75.9 -35.89 59.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.214 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.653 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 2.8 mm-40 -112.04 -4.99 14.33 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.529 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -136.92 -6.65 1.87 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 179.697 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.518 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 72.94 -7.73 9.11 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.219 -0.991 . . . . 0.0 113.804 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.609 ' O ' HG22 ' A' ' 64' ' ' THR . 1.0 OUTLIER -96.6 129.14 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.005 0.431 . . . . 0.0 111.161 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.9 pt-20 -110.63 170.2 8.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 -179.682 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.544 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.13 -36.3 5.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.156 179.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.87 -24.04 74.27 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.53 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.572 ' CB ' HG22 ' A' ' 70' ' ' ILE . 5.8 mm100 -97.1 -4.04 40.14 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.676 -0.308 . . . . 0.0 111.485 -179.673 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.817 HD21 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -131.59 -170.93 2.48 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.898 0.38 . . . . 0.0 110.257 178.128 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.426 ' H ' ' H ' ' A' ' 102' ' ' GLU . 34.6 m -133.65 100.06 4.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.605 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.672 HD12 ' HB3' ' A' ' 101' ' ' ALA . 12.2 mm -72.26 113.11 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.732 -179.608 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.73 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.2 mp -73.49 144.95 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -100.17 148.96 24.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.205 -179.65 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.1 -17.44 57.09 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.714 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.503 ' CG ' ' HG ' ' A' ' 100' ' ' LEU . 30.5 t80 -100.3 102.45 13.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.443 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -126.02 135.59 51.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.004 0.431 . . . . 0.0 110.42 179.366 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.627 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -163.56 145.93 9.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.574 179.962 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.688 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -136.15 116.43 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.983 0.421 . . . . 0.0 111.908 179.88 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.516 HD13 ' C ' ' A' ' 135' ' ' GLU . 6.9 mt -77.73 119.17 20.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.956 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -112.82 119.98 39.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.862 -179.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.8 p90 -167.28 144.34 4.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.258 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.643 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.2 p -81.84 115.38 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.416 0.627 . . . . 0.0 110.387 179.156 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.46 ' HB3' ' H ' ' A' ' 90' ' ' ARG . . . -72.72 -98.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.938 -178.309 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.46 ' H ' ' HB3' ' A' ' 89' ' ' ALA . 0.0 OUTLIER -78.39 -35.55 47.09 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.099 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.538 ' O ' ' HE2' ' A' ' 92' ' ' LYS . 1.1 m-20 -174.6 18.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.359 179.616 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -150.77 128.39 5.67 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-O 120.992 0.425 . . . . 0.0 110.883 -179.94 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.643 ' HA ' ' HA ' ' A' ' 88' ' ' VAL . 60.3 Cg_endo -74.09 118.32 5.35 Favored 'Trans proline' 0 CA--C 1.509 -0.768 0 C-N-CA 123.397 2.732 . . . . 0.0 112.973 -179.293 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 10' ' ' ALA . 4.5 ttpt -101.53 121.82 42.68 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.168 -179.373 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.543 HG22 ' HB2' ' A' ' 84' ' ' GLU . 24.1 m -86.69 108.06 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 178.272 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.688 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 30.0 t -105.92 108.19 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.706 -178.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.754 HG22 ' CH2' ' A' ' 99' ' ' TRP . 1.3 mm -85.92 124.75 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.31 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.549 ' HB3' ' CG1' ' A' ' 14' ' ' ILE . 35.9 m-85 -110.72 130.83 55.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.847 -178.203 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.754 ' CH2' HG22 ' A' ' 97' ' ' ILE . 6.3 m-90 -116.49 150.54 37.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.783 178.43 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.73 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 26.2 mt -78.89 132.88 36.94 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.672 ' HB3' HD12 ' A' ' 77' ' ' ILE . . . -139.98 140.96 36.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.994 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.557 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.4 tt0 -123.91 113.43 18.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.751 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.817 HG13 HD21 ' A' ' 75' ' ' LEU . 17.1 m -72.21 110.23 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 121.416 0.627 . . . . 0.0 110.396 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -58.56 -13.48 5.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.918 -179.038 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.7 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 65.0 t0 -108.26 114.76 28.88 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.025 0.441 . . . . 0.0 111.526 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . 0.42 ' CE1' ' CD ' ' A' ' 17' ' ' ARG . 0.5 OUTLIER -61.91 -42.54 99.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.121 179.357 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.451 ' CG ' ' HD2' ' A' ' 105' ' ' ASP . 4.2 p-10 -96.58 25.23 5.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.103 179.014 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.7 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.7 p -49.33 147.28 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.347 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.427 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.7 pm0 -72.43 142.73 48.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.321 0.581 . . . . 0.0 110.822 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.821 ' CG2' HD21 ' A' ' 112' ' ' LEU . 44.4 mm -121.48 98.69 6.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.518 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.99 101.89 13.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.531 -179.169 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.821 HD21 ' CG2' ' A' ' 110' ' ' ILE . 4.5 mt -92.07 160.81 15.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.016 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.21 -170.82 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.649 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -66.34 -34.67 78.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.324 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.19 -6.4 49.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.591 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.551 ' CB ' ' HB3' ' A' ' 112' ' ' LEU . 3.1 m-70 -110.93 127.86 55.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 111.131 -179.671 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.452 ' CG ' ' HG2' ' A' ' 35' ' ' GLN . 1.4 pp0? -99.41 -23.2 15.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.068 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.4 -177.57 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 111.956 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.767 ' CE2' HG13 ' A' ' 110' ' ' ILE . 40.7 p90 -147.44 169.51 19.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.186 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.456 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 96.5 mtt180 -153.89 154.72 34.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.236 0.541 . . . . 0.0 111.63 -179.859 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.522 ' CH2' HG21 ' A' ' 103' ' ' VAL . 78.3 m95 -119.31 107.06 12.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.468 178.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.734 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.28 169.31 18.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.102 0.477 . . . . 0.0 111.632 -178.144 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.455 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . -71.42 -154.05 1.58 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.731 179.499 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.765 ' HB2' ' HD1' ' A' ' 144' ' ' HIS . 7.0 tp -76.79 -42.55 40.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.864 0.364 . . . . 0.0 111.359 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.513 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.8 pt-20 -63.08 -47.16 84.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.819 -179.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.54 -38.83 62.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.941 0.401 . . . . 0.0 110.544 -179.741 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.545 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -64.29 -29.52 70.61 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.496 0.665 . . . . 0.0 109.209 178.465 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.417 ' SG ' ' HG3' ' A' ' 137' ' ' LYS . 43.9 m -84.01 -36.35 23.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.611 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.658 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.8 OUTLIER -59.35 -44.79 92.63 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.742 -179.95 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.734 ' CD1' HD11 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -75.85 -39.69 56.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.701 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.9 52.59 1.26 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.176 178.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . 0.421 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.92 -31.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.59 -178.815 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.783 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 25.5 m-85 -63.18 121.29 13.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.705 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 137' ' ' LYS . 9.3 tttt -46.48 -54.31 9.5 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.158 0.504 . . . . 0.0 111.853 -179.494 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.783 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 14.0 mp0 -41.29 -54.92 2.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.1 -179.24 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.691 ' HE1' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -63.23 -30.92 71.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.331 . . . . 0.0 110.613 179.875 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -58.07 -36.58 73.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.899 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.556 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -76.99 -46.95 22.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.215 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -50.81 -50.82 55.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.074 0.464 . . . . 0.0 110.209 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . 0.401 HD21 ' HB1' ' A' ' 127' ' ' ALA . 0.8 OUTLIER -72.15 -32.01 66.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.994 178.798 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.556 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -59.06 -51.99 67.66 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.893 -179.753 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.449 ' CB ' ' HE2' ' A' ' 81' ' ' PHE . 1.5 mt-10 -69.57 -27.6 65.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.366 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.91 -48.62 65.92 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.916 179.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.798 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.6 OUTLIER -80.7 -32.72 35.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.078 0.466 . . . . 0.0 110.325 179.551 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -65.96 -52.62 48.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.972 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -61.63 -53.48 55.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.622 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.639 HD12 ' CZ ' ' A' ' 16' ' ' PHE . 92.8 mt -57.61 -29.94 64.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.463 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -24.46 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.546 179.549 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.24 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.601 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.516 -0.347 0 CA-C-O 121.363 0.602 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.657 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.6 131.58 54.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.282 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.62 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 2.5 mtm180 -81.89 128.35 33.95 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.836 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.62 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.32 156.27 44.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.852 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 56.9 m -149.3 124.06 9.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.002 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.623 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.44 168.91 13.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.672 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.558 HD11 ' CD1' ' A' ' 77' ' ' ILE . 1.5 mt -118.99 117.68 29.44 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.833 -179.094 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.771 HG13 ' HB3' ' A' ' 98' ' ' TYR . 38.7 mt -82.18 92.37 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.686 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 27.7 mt -86.39 145.57 7.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.783 -177.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.81 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.3 p90 -150.83 123.67 8.64 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -178.967 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.579 ' HG2' HG23 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -82.1 112.53 19.23 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.046 -179.858 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.826 0.346 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ILE . . . . . 0.81 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.9 mt -98.64 147.26 7.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.205 0.526 . . . . 0.0 112.143 -178.839 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.623 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.9 mt-10 -138.92 124.68 19.7 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.776 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.686 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.1 m-85 -88.76 147.1 24.64 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.685 HD21 HD11 ' A' ' 15' ' ' ILE . 45.5 tp -85.87 132.62 34.06 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.843 178.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 43' ' ' TRP . 4.4 mt -133.03 144.55 50.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.878 0.37 . . . . 0.0 110.757 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.633 HD23 HD23 ' A' ' 112' ' ' LEU . 63.4 mt -123.31 106.71 10.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.052 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.489 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 3.1 tt0 -60.02 139.05 57.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.504 179.347 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' HIS . . . . . 0.593 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 1.8 p-80 . . . . . 0 CA--C 1.519 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.642 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 54.9 m95 -100.05 157.94 16.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.093 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -173.19 130.62 0.57 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.221 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -50.99 169.12 0.19 Allowed 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.025 1.817 . . . . 0.0 112.091 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' PRO . . . . . 0.809 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 16.5 Cg_exo -64.25 81.14 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.492 2.128 . . . . 0.0 111.847 179.606 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -104.55 151.92 23.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.133 -179.786 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.65 -172.69 12.87 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.592 -179.814 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 p80 -109.74 110.82 21.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.713 0.292 . . . . 0.0 110.456 179.636 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.62 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 1.8 p -79.71 132.97 30.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.507 0.67 . . . . 0.0 111.135 -179.083 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.716 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.9 tt0 -91.03 152.79 44.6 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.524 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 19.6 Cg_endo -57.17 -15.86 19.65 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.647 2.231 . . . . 0.0 112.525 -179.292 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.716 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -106.23 -11.44 27.63 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 178.982 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -87.83 170.92 10.77 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . 0.957 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -87.52 162.08 17.42 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . 0.486 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 9.6 m-20 -73.91 -63.5 1.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.864 -179.368 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.648 ' HG ' HD13 ' A' ' 61' ' ' LEU . 23.3 tp -64.63 -39.06 93.03 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.685 0.279 . . . . 0.0 110.639 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.957 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.76 -45.71 59.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.653 179.277 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.59 HG22 ' N ' ' A' ' 50' ' ' VAL . 92.4 m -59.5 -43.46 93.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.199 0.523 . . . . 0.0 109.655 179.513 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 12' ' ' GLY . . . -71.39 -29.73 65.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.194 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.96 HD21 ' HB1' ' A' ' 72' ' ' ALA . 94.1 mt -74.9 -52.97 9.9 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.038 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.13 -38.08 85.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.641 -179.849 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' THR . . . -63.39 -33.8 76.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.025 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.809 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 40.9 m -62.58 -54.71 35.59 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.572 179.44 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.526 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.47 -25.03 61.28 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.697 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 3.2 mm-40 -78.06 -33.55 50.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.076 179.53 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.584 ' HB3' ' HD1' ' A' ' 116' ' ' HIS . 57.3 mt-10 -112.9 6.94 18.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.959 -179.173 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.617 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.01 -7.21 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.581 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 72.62 -3.24 26.91 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.461 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.591 HG21 ' CD2' ' A' ' 75' ' ' LEU . 1.3 mt -101.02 120.69 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-O 121.154 0.502 . . . . 0.0 110.97 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.445 ' C ' HD12 ' A' ' 75' ' ' LEU . 1.1 pt-20 -106.15 170.69 7.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.198 -179.217 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.96 ' HB1' HD21 ' A' ' 61' ' ' LEU . . . -49.56 -33.03 13.86 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.124 0.488 . . . . 0.0 110.251 179.064 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.505 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -70.66 -11.46 68.95 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.479 179.837 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.558 ' HA ' HE21 ' A' ' 74' ' ' GLN . 0.0 OUTLIER -113.7 -13.47 12.68 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.822 0.311 . . . . 0.0 111.053 179.286 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.728 HD22 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -120.32 -173.13 2.5 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.805 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.504 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 33.8 m -131.62 98.12 4.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.384 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.612 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 14.8 mm -70.64 102.17 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.361 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.461 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -65.3 140.02 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 110.437 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -97.83 150.97 20.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.555 -179.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.13 -21.85 38.49 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.651 179.634 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.494 ' CB ' HD11 ' A' ' 100' ' ' LEU . 12.3 t80 -108.93 126.17 52.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.816 0.341 . . . . 0.0 111.368 -179.59 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.668 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.8 134.29 8.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.188 179.51 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -157.78 145.66 18.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.708 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -123.48 136.18 54.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 179.561 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.479 HD11 ' C ' ' A' ' 135' ' ' GLU . 10.8 mt -100.01 119.09 37.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.097 179.761 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.7 118.64 37.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.466 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.542 ' CD2' ' HG2' ' A' ' 135' ' ' GLU . 17.1 p90 -167.22 147.41 5.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.012 179.748 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.702 ' O ' HG11 ' A' ' 88' ' ' VAL . 9.9 p -83.81 112.88 21.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 179.232 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.85 -100.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.761 -178.494 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -45.84 88.99 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.143 0.497 . . . . 0.0 110.241 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.497 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 1.1 t30 -174.74 21.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.218 179.531 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.657 ' HB3' HD13 ' A' ' 8' ' ' LEU . 7.8 tptt -151.25 130.91 6.73 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.601 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 48.2 Cg_endo -67.74 118.61 5.73 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.388 2.725 . . . . 0.0 112.554 -179.436 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.582 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 8.5 mtpp -106.15 123.37 47.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.65 -178.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.8 m -89.21 105.75 17.99 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.735 HG11 ' CE2' ' A' ' 98' ' ' TYR . 20.3 t -105.7 108.19 24.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.655 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -87.41 126.55 41.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 178.062 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' TYR . . . . . 0.771 ' HB3' HG13 ' A' ' 14' ' ' ILE . 39.1 m-85 -114.9 128.88 56.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.109 0.481 . . . . 0.0 111.76 -178.775 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' TRP . . . . . 0.668 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -113.29 147.24 37.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.106 179.198 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.646 HD13 HD22 ' A' ' 147' ' ' LEU . 12.9 mt -78.37 132.93 37.58 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' ALA . . . . . 0.603 ' HB3' HD13 ' A' ' 77' ' ' ILE . . . -142.71 144.57 32.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.908 0.385 . . . . 0.0 111.286 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.446 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.3 tm-20 -124.6 114.7 19.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.491 179.153 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.728 HG13 HD22 ' A' ' 75' ' ' LEU . 5.1 m -71.85 123.7 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-O 121.376 0.607 . . . . 0.0 110.065 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 1.4 mttm -60.13 -28.58 68.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.29 -177.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' ASP . . . . . 0.695 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.3 t0 -102.11 121.35 42.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 0.0 111.722 -178.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -43.63 94.28 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.81 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -99.66 25.9 6.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.703 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.695 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.8 p -42.99 151.39 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.332 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' GLU . . . . . 0.402 ' N ' HG23 ' A' ' 108' ' ' VAL . 6.3 pm0 -69.95 141.85 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.174 0.511 . . . . 0.0 111.233 -179.209 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.722 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.3 mm -120.34 98.01 5.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.808 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' ARG . . . . . 0.581 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 3.3 mtp180 -98.32 97.51 8.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.554 -179.128 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.633 HD23 HD23 ' A' ' 34' ' ' LEU . 10.2 mt -92.66 125.51 37.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.43 ' C ' ' H ' ' A' ' 115' ' ' GLU . 54.5 m -82.8 -166.38 1.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.357 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -75.7 19.47 0.2 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.64 0.257 . . . . 0.0 111.329 179.784 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 115' ' ' GLU . . . . . 0.43 ' H ' ' C ' ' A' ' 113' ' ' SER . 50.7 mt-10 -105.26 -34.11 7.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.788 0.327 . . . . 0.0 110.626 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.592 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 11.0 m80 -118.1 137.32 53.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -85.27 -27.29 26.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.842 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.0 174.35 6.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 111.583 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.722 ' CE2' HG13 ' A' ' 110' ' ' ILE . 23.6 p90 -136.97 174.01 11.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.509 -179.266 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' ARG . . . . . 0.464 ' HG3' ' CH2' ' A' ' 43' ' ' TRP . 1.7 mtt-85 -157.94 162.38 38.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.215 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' TRP . . . . . 0.556 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -131.0 107.16 8.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.861 179.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.558 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.89 172.36 12.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.012 0.434 . . . . 0.0 111.42 -178.838 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.426 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . -78.81 -151.7 5.95 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.732 -0.746 . . . . 0.0 111.665 179.405 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 141' ' ' GLN . 5.5 tp -77.53 -39.74 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.797 0.332 . . . . 0.0 111.187 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -63.03 -50.62 69.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.797 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . 0.558 ' HB3' ' CD2' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -71.39 -46.9 59.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.111 -179.564 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.481 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.11 -27.55 54.29 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.225 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 128' ' ' CYS . . . . . 0.47 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -82.5 -31.77 29.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.647 178.58 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.685 HE21 ' HG ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -65.99 -45.24 82.34 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.096 -179.676 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.685 ' HG ' HE21 ' A' ' 129' ' ' GLN . 0.5 OUTLIER -78.47 -40.01 36.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.359 179.239 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.535 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -73.72 49.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.771 179.583 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.82 -31.23 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.151 -179.182 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -61.6 118.75 7.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.83 0.348 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -46.24 -38.11 8.06 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.542 ' HG2' ' CD2' ' A' ' 87' ' ' TYR . 1.8 mp0 -59.65 -56.98 15.08 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.273 -179.391 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 136' ' ' MET . . . . . 0.535 ' CB ' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -54.33 -45.13 72.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.028 -179.406 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 137' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.06 -35.3 46.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.591 179.672 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.489 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.47 -46.51 22.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.681 179.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 139' ' ' ALA . . . . . 0.446 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -53.11 -48.36 67.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.442 179.425 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.48 -25.98 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.092 178.854 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 141' ' ' GLN . . . . . 0.58 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.46 -51.83 52.65 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.09 179.942 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 142' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 10.0 mm-40 -69.93 -28.74 65.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.513 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.8 93.01 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.04 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 144' ' ' HIS . . . . . 0.527 ' CD2' HD12 ' A' ' 29' ' ' ILE . 5.7 t-80 -76.11 -28.84 57.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.342 179.394 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -70.6 -50.1 40.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.091 -179.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -67.8 -52.08 41.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.149 -179.667 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.646 HD11 ' CZ ' ' A' ' 16' ' ' PHE . 96.1 mt -57.27 -27.71 62.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.529 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.53 -21.73 66.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.683 179.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.197 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.895 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.507 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -72.39 92.06 0.76 Allowed 'Trans proline' 0 N--CA 1.447 -1.243 0 C-N-CA 124.329 3.353 . . . . 0.0 109.617 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.59 149.05 40.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 0.0 111.022 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.36 -15.06 0.9 Allowed Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.347 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.2 p -85.7 111.76 20.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.937 0.369 . . . . 0.0 111.05 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 11.3 tpt -87.6 124.43 33.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.964 179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.594 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 71.1 167.41 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.214 0.53 . . . . 0.0 111.399 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.608 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -106.53 139.2 41.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.788 -179.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.37 125.37 33.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.13 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -136.09 167.01 22.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.744 179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -157.83 123.89 4.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.079 0.466 . . . . 0.0 111.18 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.7 169.72 13.14 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.035 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.477 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -124.64 117.75 24.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.63 0.252 . . . . 0.0 111.596 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.445 HG13 ' HB3' ' A' ' 98' ' ' TYR . 23.7 mt -85.95 91.99 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.603 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 26.1 mt -82.46 146.02 7.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.874 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.609 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 45.8 p90 -150.04 125.2 10.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.701 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.408 ' HG2' HG21 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -88.77 113.53 24.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.798 0.332 . . . . 0.0 110.343 178.933 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 18' ' ' ARG . 12.6 ttp180 -89.54 117.56 28.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -73.36 160.28 32.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.744 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.0 tp -55.24 -82.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.375 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.8 pp -110.86 156.13 41.24 Favored Pre-proline 0 C--N 1.333 -0.137 0 CA-C-O 120.738 0.304 . . . . 0.0 111.376 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.83 157.53 58.52 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.694 2.262 . . . . 0.0 112.16 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.5 mmtt -106.43 -78.33 0.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -93.19 12.55 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.436 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.69 14.91 9.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.281 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -111.57 -75.06 0.62 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.951 0.405 . . . . 0.0 110.559 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -88.66 175.99 7.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.506 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 177.19 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.92 0.391 . . . . 0.0 111.184 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.496 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -105.76 148.03 10.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.329 0.585 . . . . 0.0 111.847 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.609 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 8.4 mt-10 -122.34 173.78 7.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.863 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 34.0 m-85 -138.55 133.56 32.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.63 0.252 . . . . 0.0 111.35 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.603 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.2 tp -76.8 133.21 39.46 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.413 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.4 mt -132.98 144.53 50.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.98 0.419 . . . . 0.0 111.019 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 54.3 mt -123.13 116.54 23.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.464 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 7.5 tt0 -74.55 132.35 41.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.184 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -56.64 151.09 14.46 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.04 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.2 p -82.77 1.4 39.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.426 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -171.0 -175.3 1.7 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.726 0.298 . . . . 0.0 110.926 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.9 -130.45 11.59 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.478 ' O ' HG12 ' A' ' 40' ' ' ILE . 14.8 tt -83.94 -1.53 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.806 0.336 . . . . 0.0 111.312 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 60.13 34.7 21.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.016 0.436 . . . . 0.0 110.468 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 -65.14 158.36 26.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.788 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.475 ' CE2' HD22 ' A' ' 130' ' ' LEU . 72.6 m95 -108.27 123.09 48.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.4 p -147.11 151.28 40.72 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.741 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.472 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 41.7 Cg_endo -66.79 168.3 17.25 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.493 2.128 . . . . 0.0 111.86 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.549 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 36.1 Cg_exo -60.3 99.53 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.588 2.192 . . . . 0.0 112.775 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 4.4 pttt -106.83 140.1 40.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.683 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.36 178.42 16.76 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.628 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.71 94.22 5.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.791 0.329 . . . . 0.0 110.666 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.465 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.7 p -69.56 132.13 33.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.068 0.461 . . . . 0.0 111.031 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.553 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.3 tt0 -95.35 151.88 38.96 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.119 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.3 Cg_endo -49.38 -33.08 28.18 Favored 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.682 2.255 . . . . 0.0 112.585 -179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.513 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -90.4 -13.38 60.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.345 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -87.67 165.12 15.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.553 0.216 . . . . 0.0 110.528 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.87 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 33.8 t70 -82.79 161.34 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.078 0.466 . . . . 0.0 110.711 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.5 -63.62 1.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.436 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.5 tp -61.87 -40.12 94.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.491 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.87 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -50.81 -50.06 57.14 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.465 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 86.7 m -54.88 -36.81 65.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.22 -32.09 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.043 178.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.437 HD23 ' HB1' ' A' ' 72' ' ' ALA . 93.9 mt -72.03 -53.03 14.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.641 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.5 ttt-85 -59.02 -43.61 91.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.416 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.573 ' HB1' ' HE2' ' A' ' 67' ' ' GLU . . . -58.62 -33.61 70.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.279 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.549 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 27.2 m -62.93 -53.78 48.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.328 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.485 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.4 pt20 -74.17 -23.05 59.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.726 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.47 -37.46 36.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.573 ' HE2' ' HB1' ' A' ' 63' ' ' ALA . 1.3 mp0 -110.07 9.84 24.1 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.81 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -153.25 -14.55 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.527 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 80.2 -6.41 60.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.485 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.6 mt -98.03 127.41 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.499 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.8 pt-20 -107.5 170.3 8.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.497 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.62 -31.34 10.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.9 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.46 -21.03 79.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.184 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -97.38 -5.6 35.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.648 0.261 . . . . 0.0 111.069 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.552 HD23 HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -131.03 -167.82 1.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.781 0.324 . . . . 0.0 110.292 179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.509 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -140.02 97.48 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.897 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.451 HD11 ' HB2' ' A' ' 101' ' ' ALA . 9.2 mm -70.77 112.83 6.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.018 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.97 134.6 29.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -94.26 151.28 19.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.36 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.81 -21.98 40.14 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.524 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.465 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 18.9 t80 -106.29 126.55 52.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.798 0.333 . . . . 0.0 110.869 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.471 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.75 125.97 5.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.083 0.468 . . . . 0.0 111.55 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.633 HH12 ' HE2' ' A' ' 84' ' ' GLU . 8.0 tpt85 -152.45 136.47 16.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.905 179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.638 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -118.74 143.9 46.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.082 0.468 . . . . 0.0 111.651 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.469 HD12 ' HE2' ' A' ' 98' ' ' TYR . 3.8 mt -100.47 124.73 46.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.137 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -114.95 120.17 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.021 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 9.0 p90 -167.07 144.83 4.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.122 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 10.9 p -83.99 109.0 16.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.444 ' HB2' " H4'" ' A' ' 154' ' ' ATP . . . -70.78 -93.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.433 ' HG3' ' OD1' ' A' ' 91' ' ' ASN . 12.8 ptt85 -74.8 -48.17 26.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.857 0.36 . . . . 0.0 110.351 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.433 ' OD1' ' HG3' ' A' ' 90' ' ' ARG . 20.2 p-10 -171.47 30.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.669 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.608 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.37 125.58 2.65 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.557 179.62 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.594 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 52.6 Cg_endo -68.08 117.79 5.17 Favored 'Trans proline' 0 CA--C 1.513 -0.571 0 C-N-CA 123.273 2.649 . . . . 0.0 112.816 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.483 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -101.5 124.35 47.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.741 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.7 m -90.53 112.04 23.57 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.638 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 32.5 t -109.06 108.96 26.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.642 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.599 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.68 142.89 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.472 ' CE1' ' HG2' ' A' ' 45' ' ' PRO . 7.7 m-85 -126.3 133.61 51.36 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.477 ' HB2' HD22 ' A' ' 13' ' ' LEU . 14.5 m-90 -124.07 143.34 50.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.444 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.465 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -80.96 128.53 33.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.224 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.509 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -134.43 142.17 47.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.178 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.537 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 10.9 tt0 -119.5 115.28 23.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.646 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.552 HG11 HD23 ' A' ' 75' ' ' LEU . 11.9 m -72.24 129.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 121.304 0.574 . . . . 0.0 110.653 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' CD ' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.69 -27.1 68.46 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.794 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.434 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 1.3 m-20 -106.35 132.77 52.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.111 0.481 . . . . 0.0 111.969 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -69.09 -43.25 74.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.458 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -100.21 24.02 9.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.811 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.434 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 2.9 p -41.89 147.22 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.75 144.64 54.37 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.306 0.574 . . . . 0.0 110.768 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.57 ' CG2' HD21 ' A' ' 112' ' ' LEU . 30.5 mm -124.26 96.81 4.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.928 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.527 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 15.2 mtp180 -106.77 99.77 9.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.97 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.57 HD21 ' CG2' ' A' ' 110' ' ' ILE . 8.3 mt -85.68 172.86 10.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.528 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.11 -172.72 2.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.847 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -60.13 -29.57 68.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.09 -6.98 52.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.779 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.437 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 52.9 m80 -142.05 127.88 19.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.0 110.995 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.26 -18.94 15.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.513 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.03 163.67 39.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 111.43 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.492 ' CE2' HG13 ' A' ' 110' ' ' ILE . 38.5 p90 -138.25 175.16 9.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.713 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.421 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 4.1 mtt85 -158.68 158.66 34.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 0.0 111.509 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 87.5 m95 -127.1 106.74 9.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.62 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 31' ' ' PHE . 0.1 OUTLIER -138.15 167.62 21.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.066 0.46 . . . . 0.0 111.585 -178.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.74 -153.51 3.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.707 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.03 -46.69 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.843 0.322 . . . . 0.0 110.845 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.47 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.2 pt-20 -56.14 -49.34 74.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.724 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.9 -50.68 22.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.551 -179.503 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.413 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -50.38 -29.63 10.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 2.3 m -83.94 -33.94 24.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.392 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.724 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.29 -41.43 94.12 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.585 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.55 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -77.6 -44.33 28.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.88 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.88 52.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.142 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.401 ' O ' ' HE3' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -37.8 -34.11 0.1 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.131 -179.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.478 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 21.2 m-85 -54.8 114.77 1.84 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.127 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -45.8 -50.81 13.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.519 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.447 ' CD ' HN62 ' A' ' 154' ' ' ATP . 11.3 mp0 -46.03 -46.97 16.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.624 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.448 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -71.36 -45.24 63.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.696 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.61 -30.24 12.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.518 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -79.77 -47.01 15.94 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.842 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -51.61 -47.47 63.6 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.032 0.444 . . . . 0.0 110.423 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.86 -27.67 61.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.024 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.518 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.19 -51.45 53.42 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.639 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -67.06 -30.74 70.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.55 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.5 -56.62 22.66 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.948 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -67.78 -28.26 67.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.771 0.319 . . . . 0.0 110.45 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -68.55 -43.71 76.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.481 ' CE2' HD12 ' A' ' 150' ' ' ILE . 64.2 t80 -72.67 -52.58 14.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.256 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.475 HD11 ' CZ ' ' A' ' 16' ' ' PHE . 32.2 mt -52.23 -34.84 47.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.658 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.6 t -90.5 -10.74 42.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.264 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.481 HD12 ' CE2' ' A' ' 146' ' ' PHE . 0.3 OUTLIER -95.74 -142.3 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 179.7 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -142.9 -68.52 0.35 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.938 0.399 . . . . 0.0 110.479 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -163.76 -42.59 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.089 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.946 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.559 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.545 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.39 -36.99 4.72 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.332 3.355 . . . . 0.0 109.624 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.8 142.68 58.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.077 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.42 -137.07 9.85 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.553 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 61.9 m -98.58 -18.51 18.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 0.0 110.994 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.27 172.9 0.4 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.929 0.395 . . . . 0.0 110.562 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.593 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 66.99 163.6 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.916 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.497 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -104.11 127.82 51.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.113 -179.719 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 121.83 25.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.024 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -138.74 160.52 39.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.827 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.9 m -148.19 123.66 10.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.237 0.541 . . . . 0.0 111.146 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.85 170.94 13.45 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.678 179.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.408 HD23 HD11 ' A' ' 77' ' ' ILE . 0.3 OUTLIER -124.67 117.24 23.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.859 0.361 . . . . 0.0 110.798 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.575 HG13 ' HB3' ' A' ' 98' ' ' TYR . 62.8 mt -82.87 92.32 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 26.1 mt -82.64 145.73 8.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.186 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.653 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 29.0 p90 -149.62 124.08 9.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.837 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.619 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -87.12 113.51 22.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.4 . . . . 0.0 110.654 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -86.71 113.39 22.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -72.2 159.96 33.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.635 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 tp -59.83 -82.36 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.846 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.433 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 2.1 pp -114.54 148.39 40.17 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.661 0.267 . . . . 0.0 111.081 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 9.1 Cg_exo -72.06 158.77 51.66 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.831 2.354 . . . . 0.0 112.857 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -78.49 0.59 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.524 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 18.7 t -88.28 3.62 5.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.391 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 64.26 19.33 11.74 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.248 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -110.74 -71.6 0.76 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.874 0.369 . . . . 0.0 110.795 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -95.75 118.28 32.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.427 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -127.68 -48.47 1.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 0.0 111.446 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.653 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.0 mt -101.17 148.33 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.616 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 16.8 mp0 -134.86 134.27 40.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.725 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.584 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -96.35 150.04 21.03 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.557 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.9 tp -82.97 135.93 34.71 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.098 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.2 mt -135.54 142.65 45.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.868 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 8.8 mt -123.29 113.63 19.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.08 -179.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.488 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.9 tt0 -69.09 122.26 18.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.39 130.27 45.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.426 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 90.8 p -73.36 0.32 12.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.519 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -146.56 -164.98 2.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.485 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.87 -130.13 33.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.564 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.4 pt -95.58 9.22 5.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.512 0.196 . . . . 0.0 111.405 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.43 57.21 1.53 Allowed 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -107.45 150.44 26.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.832 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.658 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 10.1 m95 -95.84 139.21 32.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.05 136.64 9.41 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.748 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -49.17 169.08 0.11 Allowed 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.781 1.654 . . . . 0.0 111.018 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.687 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 1.5 Cg_endo -78.16 101.06 1.43 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.027 1.818 . . . . 0.0 112.141 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -120.88 -173.11 2.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.46 -139.41 2.67 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.352 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -131.57 127.23 36.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.531 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 0.2 OUTLIER -81.6 135.51 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-O 120.95 0.405 . . . . 0.0 110.599 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.461 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -87.18 170.43 12.1 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.004 -179.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 76.8 Cg_exo -49.68 -63.29 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.793 2.328 . . . . 0.0 112.87 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.9 19.27 42.77 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.432 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.442 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 30.5 tt0 -90.6 160.77 15.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.976 0.388 . . . . 0.0 110.754 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.878 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -85.31 162.69 18.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.057 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.524 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -72.13 -62.98 1.24 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.086 0.47 . . . . 0.0 110.737 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.455 ' HG ' ' HG ' ' A' ' 61' ' ' LEU . 21.9 tp -61.97 -42.53 99.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.316 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.878 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.2 mt-10 -50.35 -46.87 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.73 0.3 . . . . 0.0 110.516 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.531 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 87.6 m -54.63 -37.36 65.56 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.09 -32.74 50.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.122 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.455 ' HG ' ' HG ' ' A' ' 57' ' ' LEU . 95.2 mt -70.95 -53.46 14.84 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.73 -38.86 89.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.038 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.53 -33.79 76.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.045 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.687 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 90.0 m -58.55 -51.92 67.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.393 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.531 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.63 -20.96 61.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.919 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.67 -41.67 30.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.755 0.312 . . . . 0.0 111.17 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -108.08 6.34 26.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.614 -179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -148.24 -7.96 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.608 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 70.95 -1.94 20.87 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.143 -1.027 . . . . 0.0 113.241 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.531 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.4 mt -100.92 127.67 53.86 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.042 0 CA-C-N 117.035 0.418 . . . . 0.0 110.811 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.42 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.1 pm0 -108.32 166.6 10.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.12 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.54 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.71 -34.55 5.24 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.734 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.41 -23.78 77.24 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.292 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.493 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 2.9 mm-40 -93.72 -5.83 47.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.395 0.14 . . . . 0.0 111.233 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.54 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.42 -171.35 2.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.996 0.427 . . . . 0.0 110.64 178.775 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.8 m -138.98 99.02 3.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.408 HD11 HD23 ' A' ' 13' ' ' LEU . 7.6 mm -71.58 120.38 19.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.443 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.33 131.33 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.221 0.534 . . . . 0.0 110.937 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -90.59 148.81 22.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.211 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.72 -24.32 30.03 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.285 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -103.71 125.62 50.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.691 0.282 . . . . 0.0 110.864 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.439 ' HD2' ' HZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.09 123.59 4.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 111.414 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.541 ' HD3' ' HE2' ' A' ' 142' ' ' GLU . 3.5 tpt85 -152.34 138.16 18.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.683 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.631 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.3 OUTLIER -114.69 134.02 55.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.429 -179.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.402 HD13 ' C ' ' A' ' 135' ' ' GLU . 8.2 mt -91.11 122.67 33.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.524 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -115.89 123.49 48.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.33 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -167.05 142.03 4.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.823 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.472 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 9.2 p -82.02 109.86 16.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.441 ' CB ' " H4'" ' A' ' 154' ' ' ATP . . . -77.29 -98.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.007 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -38.3 84.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 176.79 27.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.076 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.503 ' HG3' ' HD2' ' A' ' 93' ' ' PRO . 0.4 OUTLIER -158.82 130.67 4.09 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.478 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.593 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 47.6 Cg_endo -66.46 120.46 7.59 Favored 'Trans proline' 0 CA--C 1.516 -0.392 0 C-N-CA 123.381 2.721 . . . . 0.0 113.024 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.485 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 1.2 mmmt -101.31 123.21 45.05 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.794 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -95.73 109.0 21.36 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.631 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 t -108.41 108.82 26.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.977 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.604 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.14 125.29 40.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.575 ' HB3' HG13 ' A' ' 14' ' ' ILE . 32.7 m-85 -111.74 165.43 12.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.524 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 4.7 m-90 -152.68 138.56 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.292 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.462 ' CD2' ' N ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -75.84 124.92 28.11 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.524 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.565 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -131.49 143.71 50.61 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.357 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.594 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.0 tt0 -117.6 110.67 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.766 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.493 HG12 HG22 ' A' ' 70' ' ' ILE . 10.9 m -72.27 143.55 13.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.386 0.613 . . . . 0.0 111.589 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.518 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 3.8 mptp? -71.59 -12.53 61.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.885 -177.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.534 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 6.5 t70 -133.35 127.61 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 111.931 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.619 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 59.7 t80 -62.54 -38.43 89.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -100.3 21.3 13.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.695 178.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -43.03 145.82 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.064 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.632 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.442 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -61.85 140.19 58.29 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.32 0.581 . . . . 0.0 110.621 -179.337 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.591 ' HA ' ' O ' ' A' ' 68' ' ' ALA . 28.6 mm -123.74 95.2 3.2 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.879 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.608 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.1 mtp85 -95.3 102.32 14.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.158 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.493 HD23 ' CG2' ' A' ' 110' ' ' ILE . 11.4 mt -90.65 144.49 25.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.11 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -89.09 -156.27 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 7.0 11.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.449 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -99.12 -29.86 12.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.9 m80 -120.61 157.36 29.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.823 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -120.16 -21.4 7.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.694 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -154.59 178.6 9.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.914 0.388 . . . . 0.0 111.507 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.52 ' CZ ' ' HB ' ' A' ' 110' ' ' ILE . 42.3 p90 -156.56 161.05 39.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.866 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.658 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -148.97 148.39 29.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.038 0.447 . . . . 0.0 111.383 179.588 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 81.2 m95 -105.96 106.9 17.62 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.458 HD21 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -135.3 169.71 17.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 0.0 111.666 -178.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.33 -151.83 3.93 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.763 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.54 -45.62 24.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.767 0.318 . . . . 0.0 111.351 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.47 -52.19 66.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.803 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.683 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.02 -46.7 67.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.558 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.522 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.54 -31.12 63.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.298 0.57 . . . . 0.0 109.763 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.4 m -82.57 -30.84 29.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.183 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.683 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.73 -43.55 88.7 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.725 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.629 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -77.73 -37.42 49.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.217 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.95 56.52 1.97 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.151 0.501 . . . . 0.0 110.085 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.57 -34.06 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.255 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.422 ' HE2' " O4'" ' A' ' 154' ' ' ATP . 38.5 m-85 -59.5 115.32 3.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.185 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -46.17 -44.92 16.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.381 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.402 ' C ' HD13 ' A' ' 85' ' ' LEU . 1.2 mp0 -49.31 -60.24 2.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.264 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.417 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -54.37 -40.23 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.921 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -53.41 -39.58 64.43 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.568 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.21 -44.39 30.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.378 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.477 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -52.19 -42.74 63.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.246 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.67 -29.52 40.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.015 178.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.92 -52.24 45.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.823 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.541 ' HE2' ' HD3' ' A' ' 83' ' ' ARG . 65.9 mt-10 -66.22 -28.91 69.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.424 179.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.1 -53.67 42.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.833 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 18.0 t-80 -71.24 -30.23 66.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 0.0 110.106 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.82 -50.3 67.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.347 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.452 ' CD1' HD12 ' A' ' 150' ' ' ILE . 48.6 t80 -62.39 -52.08 65.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.738 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.508 HD13 ' CZ ' ' A' ' 16' ' ' PHE . 67.6 mt -55.03 -30.18 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.5 t -83.02 -8.43 59.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.594 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.73 -22.45 14.4 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.299 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.452 HD12 ' CD1' ' A' ' 146' ' ' PHE . 0.9 OUTLIER -67.24 -124.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 179.995 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -97.1 -60.4 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 0.0 110.247 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -56.38 118.55 4.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.441 " H4'" ' CB ' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.562 ' C ' ' H ' ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.542 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.32 26.32 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 124.294 3.329 . . . . 0.0 109.642 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.562 ' H ' ' C ' ' A' ' 1' ' ' GLY . 6.9 mp 59.56 -176.01 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.959 0.409 . . . . 0.0 111.123 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.52 -178.49 16.59 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.259 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.01 18.16 6.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.727 0.299 . . . . 0.0 111.098 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 ptm -61.06 168.38 2.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.975 0.416 . . . . 0.0 110.654 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 59.26 167.51 0.06 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.37 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -109.62 142.18 41.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.524 179.644 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.571 ' HB3' HG11 ' A' ' 50' ' ' VAL . 1.7 mtt180 -78.56 137.77 38.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.639 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -149.56 162.61 39.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.919 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.6 m -156.42 123.5 5.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.17 0.51 . . . . 0.0 111.54 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.479 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -113.47 178.0 18.29 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.555 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.414 HD21 HD13 ' A' ' 77' ' ' ILE . 1.1 mt -135.1 118.2 16.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.047 0.424 . . . . 0.0 111.801 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.49 HG12 ' HB3' ' A' ' 98' ' ' TYR . 11.2 mm -75.67 90.9 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.582 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 30.2 mt -84.97 136.65 22.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.711 -178.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.666 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.9 p90 -146.47 124.05 11.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.828 -178.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.508 ' HG3' ' CZ3' ' A' ' 121' ' ' TRP . 0.0 OUTLIER -80.47 113.21 18.49 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.008 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -94.53 117.44 30.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.424 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.2 160.35 25.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.017 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.2 mt -59.07 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.022 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.465 HD12 ' CE ' ' A' ' 23' ' ' LYS . 2.8 pp -111.24 145.94 33.55 Favored Pre-proline 0 CA--C 1.53 0.173 0 CA-C-O 120.647 0.26 . . . . 0.0 111.163 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 7.0 Cg_exo -73.68 159.23 46.07 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.928 2.419 . . . . 0.0 112.604 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' CE ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -110.53 -78.7 0.59 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.696 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.5 0.5 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.576 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 63.57 47.47 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.007 0.432 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -114.2 -51.76 2.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.629 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 29' ' ' ILE . 3.9 m-20 -110.57 -75.57 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.177 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 65.41 -65.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.501 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.666 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 12.3 mt -102.88 147.71 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 111.485 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.591 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.4 mp0 -135.85 141.39 44.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.659 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.582 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 53.4 m-85 -103.37 149.71 24.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.927 0.394 . . . . 0.0 112.018 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.554 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 43.5 tp -84.02 136.64 33.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.466 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.3 mt -136.95 143.13 42.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.609 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.9 mt -121.31 112.29 18.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.759 -179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.481 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 62.4 tt0 -60.68 134.22 56.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.315 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.59 133.44 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.626 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -80.66 5.58 15.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.526 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -168.56 -177.0 2.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.744 0.306 . . . . 0.0 110.652 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.82 -119.29 4.82 Favored Glycine 0 CA--C 1.521 0.417 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.636 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.498 HG12 ' ND1' ' A' ' 42' ' ' HIS . 3.6 pt -100.29 9.25 8.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.546 0.212 . . . . 0.0 111.471 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 61.69 37.4 15.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.453 0.644 . . . . 0.0 109.643 -178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.516 ' NE2' H5'1 ' A' ' 154' ' ' ATP . 15.0 p-80 -86.09 170.98 11.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.659 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.515 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 45.6 m95 -115.69 112.61 22.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.959 0.409 . . . . 0.0 111.267 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -125.63 143.73 45.88 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.66 171.39 12.11 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.194 1.93 . . . . 0.0 111.97 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.419 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 25.2 Cg_endo -61.49 96.24 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.436 2.091 . . . . 0.0 112.109 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.456 ' HE3' HG12 ' A' ' 96' ' ' VAL . 7.3 mttt -86.63 170.64 11.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.49 ' HA3' ' HB1' ' A' ' 63' ' ' ALA . . . -166.58 128.58 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.696 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.69 109.91 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.571 HG11 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -79.42 137.02 22.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.097 0.475 . . . . 0.0 111.15 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 4.1 tt0 -95.12 151.48 38.82 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.277 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.553 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 7.4 Cg_endo -52.57 -31.02 47.45 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.71 2.273 . . . . 0.0 112.88 -179.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.556 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -91.2 -13.38 58.86 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.508 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -87.24 161.44 18.0 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.53 0.205 . . . . 0.0 110.684 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.874 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 31.1 t70 -78.29 160.89 27.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.364 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.446 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 15.5 m-20 -71.6 -62.21 1.5 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.253 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.558 ' HG ' HD13 ' A' ' 61' ' ' LEU . 24.8 tp -62.32 -40.44 96.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.299 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.874 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -50.32 -45.01 54.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.733 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.524 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 90.2 m -60.06 -41.81 93.16 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.23 -31.3 69.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.785 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.558 HD13 ' HG ' ' A' ' 57' ' ' LEU . 96.5 mt -73.5 -52.19 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.642 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -59.5 -44.09 93.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.57 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.49 ' HB1' ' HA3' ' A' ' 48' ' ' GLY . . . -58.77 -37.1 75.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.046 0.45 . . . . 0.0 110.045 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.482 HG22 ' CD1' ' A' ' 15' ' ' ILE . 34.7 m -60.32 -54.02 50.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.549 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 10.7 pt20 -73.23 -21.7 60.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.915 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -79.32 -41.69 27.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.219 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 17.5 mp0 -106.1 2.58 27.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.722 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -144.59 -8.99 0.64 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.579 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 72.51 1.02 51.04 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.934 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.549 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 3.9 mt -103.7 122.23 56.12 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.7 pt-20 -107.24 168.55 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.441 -179.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.563 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -47.18 -36.13 8.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.507 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.62 78.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.109 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.452 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 0.2 OUTLIER -91.52 -6.6 52.25 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.704 0.288 . . . . 0.0 111.06 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.609 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -135.9 -176.2 4.23 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.86 0.362 . . . . 0.0 110.24 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 94.7 m -124.63 103.24 8.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.726 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.504 HD12 ' HB1' ' A' ' 101' ' ' ALA . 14.2 mm -77.63 109.79 12.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.905 0.383 . . . . 0.0 111.569 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.603 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -72.42 138.3 21.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.701 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -94.27 148.84 21.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.468 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.87 -23.09 34.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.736 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.468 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 34.4 t80 -100.71 125.25 47.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.38 . . . . 0.0 111.075 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.502 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.48 126.09 5.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.176 0.512 . . . . 0.0 111.273 179.693 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -153.81 137.44 16.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.202 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.726 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -118.08 134.6 54.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 0.0 111.35 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.409 HD11 ' CE2' ' A' ' 98' ' ' TYR . 8.1 mt -101.62 117.82 35.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.481 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.447 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.24 126.51 53.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.144 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -166.93 140.23 3.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.48 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 8.6 p -80.41 108.82 14.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.557 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.458 ' CB ' " H4'" ' A' ' 154' ' ' ATP . . . -76.62 -95.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.587 -178.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.493 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -69.98 -39.15 76.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.72 0.295 . . . . 0.0 110.875 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.493 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 6.2 t-20 176.41 29.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.853 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.568 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.65 123.99 2.51 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.737 179.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.618 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 59.6 Cg_endo -73.43 117.63 5.16 Favored 'Trans proline' 0 CA--C 1.515 -0.436 0 C-N-CA 123.025 2.483 . . . . 0.0 112.832 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.468 ' HG2' HD12 ' A' ' 8' ' ' LEU . 2.1 mmmt -103.0 121.73 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.349 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.2 m -88.74 113.61 24.49 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.726 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.9 t -112.44 109.41 28.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.222 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.634 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -84.92 130.14 36.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.499 ' CE2' HG11 ' A' ' 96' ' ' VAL . 37.4 m-85 -115.62 137.7 51.81 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.502 ' CE2' ' HG3' ' A' ' 82' ' ' LYS . 1.8 m-90 -125.92 143.83 50.92 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.113 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 6.2 mt -75.5 123.84 26.15 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.514 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.504 ' HB1' HD12 ' A' ' 77' ' ' ILE . . . -131.98 144.16 50.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.423 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.7 tt0 -123.64 112.63 17.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.601 0.238 . . . . 0.0 111.111 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.609 HG12 HD23 ' A' ' 75' ' ' LEU . 3.4 m -72.81 112.77 9.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.751 0.786 . . . . 0.0 110.387 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -8.78 14.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.517 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.823 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 6.1 m-20 -112.43 107.04 15.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.942 0.401 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.405 ' CD1' ' HD2' ' A' ' 17' ' ' ARG . 2.7 t80 -55.47 -39.78 70.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -101.09 26.18 7.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.69 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.823 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.5 p -47.9 146.47 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.347 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 5.9 pm0 -68.68 143.09 54.86 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.118 0.485 . . . . 0.0 110.542 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.592 HG13 ' CE2' ' A' ' 119' ' ' TYR . 42.2 mm -120.97 97.55 5.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.511 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.579 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 19.5 mtp180 -101.84 99.92 10.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.435 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.429 HD22 ' CG2' ' A' ' 110' ' ' ILE . 3.1 mt -92.06 -172.6 3.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.822 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.7 t -125.97 -172.57 2.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.811 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -66.58 -25.01 66.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.329 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.75 -12.53 60.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.29 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -124.26 105.94 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.792 0.33 . . . . 0.0 110.764 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.52 -17.0 60.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.876 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.24 -179.57 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.126 0.489 . . . . 0.0 111.703 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.592 ' CE2' HG13 ' A' ' 110' ' ' ILE . 42.3 p90 -145.65 171.89 14.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.717 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.454 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 64.9 mtt180 -157.94 153.25 25.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.244 0.545 . . . . 0.0 111.675 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.554 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 90.6 m95 -118.03 107.14 13.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.367 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.427 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -136.63 173.59 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.045 0.45 . . . . 0.0 111.684 -178.555 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -79.94 -153.24 8.25 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.798 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.46 -41.16 40.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.0 pt-20 -61.05 -51.93 67.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.749 0.309 . . . . 0.0 111.413 -179.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.688 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.36 -48.72 60.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.904 0.383 . . . . 0.0 110.227 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.466 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.94 -27.25 29.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -83.23 -32.89 26.24 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.952 178.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.688 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.76 -46.99 82.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.651 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.4 OUTLIER -78.3 -37.19 45.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.512 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.457 ' HB3' ' CB ' ' A' ' 136' ' ' MET . . . -75.36 52.22 0.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.069 0.461 . . . . 0.0 110.813 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.76 -32.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.62 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.539 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 26.0 m-85 -63.4 120.53 11.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.617 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.61 -49.41 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.006 0.431 . . . . 0.0 111.175 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -47.25 -53.24 13.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.673 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.457 ' CB ' ' HB3' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -60.03 -43.0 95.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.186 -179.243 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.5 OUTLIER -53.29 -36.57 61.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.01 -42.43 32.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.255 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.881 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.2 mt -78.39 -27.52 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.984 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.538 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.19 -51.85 33.8 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.854 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.21 -30.04 67.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.393 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.57 -49.52 72.84 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.823 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.438 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 6.4 t-160 -76.25 -36.32 58.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.053 0.454 . . . . 0.0 110.273 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -61.02 -52.72 63.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.533 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.451 ' CE1' HD13 ' A' ' 150' ' ' ILE . 24.6 t80 -60.94 -50.56 72.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.016 0.436 . . . . 0.0 111.191 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.632 HD13 ' CE1' ' A' ' 16' ' ' PHE . 94.0 mt -56.88 -31.71 65.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.678 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.16 -4.18 54.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.797 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.1 8.94 20.21 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.795 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.595 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 0.7 OUTLIER -94.67 -136.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.578 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -100.9 -62.62 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.745 0.307 . . . . 0.0 111.446 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -82.98 126.8 32.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.694 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.132 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.812 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.539 ' C8 ' ' CZ ' ' A' ' 133' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.831 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.514 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.831 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 81.7 Cg_endo -72.36 89.52 0.81 Allowed 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 124.389 3.393 . . . . 0.0 109.567 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.28 136.38 54.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.921 0.391 . . . . 0.0 110.748 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.36 56.09 4.4 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.821 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 73.4 p -72.3 155.85 39.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.667 0.27 . . . . 0.0 110.564 179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 59.19 159.38 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.685 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.649 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 58.74 164.69 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.037 0.446 . . . . 0.0 111.063 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.603 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -109.4 139.9 43.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.043 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.453 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -83.92 123.71 30.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.993 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.45 163.52 30.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 m -157.75 124.04 4.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 111.146 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.544 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.53 170.13 13.27 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.488 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.55 117.91 26.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.452 HG13 ' HB3' ' A' ' 98' ' ' TYR . 78.5 mt -86.77 91.74 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 52.7 mt -79.94 146.31 7.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.622 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.652 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 51.4 p90 -151.33 122.27 7.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.439 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.11 112.24 18.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.69 128.52 45.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.548 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -65.0 160.17 21.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.341 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.491 ' O ' HG22 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -50.11 -30.97 12.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.762 0.315 . . . . 0.0 111.163 -179.747 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.491 HG22 ' O ' ' A' ' 20' ' ' LEU . 1.3 pp -165.64 151.93 8.71 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.673 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.67 159.15 42.85 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.846 2.364 . . . . 0.0 112.119 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.91 -80.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.046 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -95.92 -9.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.363 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t70 67.36 33.98 5.04 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.895 0.379 . . . . 0.0 110.236 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -91.47 -71.11 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.469 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -127.06 33.77 4.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.271 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.54 -24.22 7.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.275 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.652 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.9 mt -129.02 140.43 49.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.453 . . . . 0.0 111.99 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -135.24 126.93 29.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.001 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.0 m-85 -89.7 150.46 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.462 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 44.0 tp -85.88 138.53 31.97 Favored 'General case' 0 CA--C 1.523 -0.059 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.866 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.5 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.5 mt -139.13 132.77 30.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.402 HD12 ' HG3' ' A' ' 46' ' ' PRO . 17.0 mt -108.92 100.2 9.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.93 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.457 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 41.1 tt0 -55.08 133.95 49.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.21 136.93 58.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.922 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.475 ' HA ' ' CB ' ' A' ' 117' ' ' GLN . 23.9 p -70.7 0.65 6.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.631 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -173.22 -165.16 0.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.783 0.325 . . . . 0.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.22 -126.11 7.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.557 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.406 ' CD1' ' HB3' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -94.36 8.17 5.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.77 42.75 10.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.35 0.595 . . . . 0.0 109.52 -178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.406 ' HB3' ' CD1' ' A' ' 40' ' ' ILE . 24.2 p-80 -91.17 142.6 27.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.791 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.533 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 5.9 m95 -101.63 128.5 47.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.49 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.51 139.4 27.19 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.265 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -56.87 164.34 6.22 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.244 1.962 . . . . 0.0 111.975 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.501 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 29.0 Cg_exo -60.34 83.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.528 0.186 0 C-N-CA 122.669 2.246 . . . . 0.0 112.314 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.544 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.48 153.09 19.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.038 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.4 -154.83 6.45 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.088 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -125.36 109.33 12.64 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.547 0.213 . . . . 0.0 110.912 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.456 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.3 p -83.21 132.59 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.554 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 2.6 tt0 -95.07 152.15 39.3 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.417 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.554 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.9 Cg_endo -49.26 -31.29 21.87 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.945 2.43 . . . . 0.0 112.831 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.532 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -94.97 -10.66 57.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.304 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -88.6 158.71 18.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.512 0.196 . . . . 0.0 110.589 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.848 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.2 t0 -76.78 160.34 29.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.012 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.92 -61.5 1.83 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.221 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.457 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.6 tp -61.39 -42.14 98.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.747 0.308 . . . . 0.0 111.076 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.848 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.26 -46.7 55.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.373 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.456 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 89.2 m -55.66 -42.32 74.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.33 -32.7 68.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.059 178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 96.5 mt -71.19 -52.97 16.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.603 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.41 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 mtt180 -58.09 -39.28 78.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.748 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.6 -30.39 71.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.114 0.483 . . . . 0.0 109.945 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.501 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 18.5 m -65.04 -50.94 64.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.64 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.56 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.5 pp0? -76.05 -24.85 55.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.933 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -79.04 -37.56 38.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.902 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.406 ' O ' HD22 ' A' ' 112' ' ' LEU . 12.9 mt-10 -104.27 -8.81 19.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.911 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -138.42 -3.25 1.73 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.79 0.24 32.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.619 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.56 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.3 mt -103.95 123.99 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.81 167.12 10.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.502 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -48.53 -27.62 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.251 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.29 -21.03 76.44 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.227 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.502 ' HG2' HG22 ' A' ' 70' ' ' ILE . 1.2 tp60 -98.06 -9.39 26.03 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.542 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -126.03 -171.23 2.34 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.097 0.475 . . . . 0.0 110.514 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 83.9 m -133.85 100.67 4.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.385 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.404 HD11 HD21 ' A' ' 61' ' ' LEU . 8.1 mm -74.14 118.38 19.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.467 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -80.74 132.83 30.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -91.04 148.57 22.3 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.122 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.1 -26.8 19.44 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.588 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.471 ' CD1' HD22 ' A' ' 100' ' ' LEU . 11.6 t80 -103.49 124.26 48.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.0 111.038 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.461 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 127.93 6.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.196 179.606 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.89 142.68 17.74 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.169 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.647 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 4.2 pm0 -120.87 141.4 50.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.105 0.479 . . . . 0.0 111.816 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.4 mt -101.36 118.73 37.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.078 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -111.42 124.44 52.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.144 0.497 . . . . 0.0 111.038 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.571 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 25.6 p90 -167.08 145.86 5.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.823 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.623 ' O ' HG13 ' A' ' 88' ' ' VAL . 11.4 p -85.62 111.86 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.764 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.43 -106.34 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.278 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -39.61 93.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.858 0.361 . . . . 0.0 110.555 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.4 t30 178.25 30.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.968 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.603 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -156.45 125.4 3.03 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.649 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 55.9 Cg_endo -70.3 116.49 4.64 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 123.206 2.604 . . . . 0.0 112.825 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.479 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -99.95 128.39 46.05 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.699 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.6 m -95.59 104.95 16.89 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 177.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.647 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 36.2 t -104.05 108.43 24.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.966 -178.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.625 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.38 136.62 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.452 ' HB3' HG13 ' A' ' 14' ' ' ILE . 37.2 m-85 -123.49 129.86 51.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.461 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 3.8 m-90 -115.03 148.88 38.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.026 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.471 HD22 ' CD1' ' A' ' 81' ' ' PHE . 6.6 mt -83.29 127.47 33.68 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.504 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -133.97 144.6 48.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.627 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.428 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -123.31 116.74 23.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.793 0.33 . . . . 0.0 111.396 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.635 ' O ' HG23 ' A' ' 103' ' ' VAL . 4.8 m -76.93 121.04 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 121.447 0.642 . . . . 0.0 110.833 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -22.24 66.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.522 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.745 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 4.6 m-20 -104.94 119.83 39.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.987 0.422 . . . . 0.0 111.712 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -43.88 95.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.168 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -96.22 21.26 9.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.079 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.745 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -42.26 145.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.367 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.661 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -62.03 141.2 58.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.318 0.58 . . . . 0.0 111.3 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.608 ' CG2' HD21 ' A' ' 112' ' ' LEU . 35.4 mm -123.99 100.48 7.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.661 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -99.67 101.61 12.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.416 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.608 HD21 ' CG2' ' A' ' 110' ' ' ILE . 17.3 mt -92.75 163.87 13.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.43 -168.9 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -64.46 -18.53 64.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.347 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.93 -18.25 35.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.688 0.28 . . . . 0.0 111.17 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -120.02 136.78 54.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.475 ' CB ' ' HA ' ' A' ' 37' ' ' SER . 6.6 tp60 -109.74 -19.17 13.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.533 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.52 166.25 16.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.869 0.366 . . . . 0.0 111.198 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.528 ' CD2' ' CG2' ' A' ' 110' ' ' ILE . 43.0 p90 -139.74 173.59 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.841 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.468 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 26.4 mtt-85 -160.68 158.33 28.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 0.0 111.486 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.405 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 86.3 m95 -122.09 107.4 12.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.28 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.43 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.67 172.7 12.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.065 0.46 . . . . 0.0 111.833 -178.198 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.0 -151.47 6.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.233 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 6.9 tp -77.3 -46.05 24.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.574 0.226 . . . . 0.0 111.539 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -58.18 -51.43 69.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.496 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.567 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -67.55 -54.1 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.069 0.461 . . . . 0.0 110.242 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.5 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -49.87 -31.11 11.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 0.0 110.157 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.7 m -83.86 -30.79 26.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.736 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.567 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -63.87 -43.4 96.18 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.788 -179.861 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.533 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -77.66 -42.55 34.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.184 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.79 54.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 0.0 110.165 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.67 -33.9 0.09 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.302 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.513 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 53.2 m-85 -59.59 120.54 9.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.676 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.38 -54.71 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.246 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.501 ' CD ' HN62 ' A' ' 154' ' ' ATP . 21.4 mp0 -41.67 -54.74 3.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.143 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.529 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -63.01 -44.64 95.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.206 -179.203 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.03 -42.58 49.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.384 . . . . 0.0 109.994 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.468 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.45 -45.04 73.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.76 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -53.16 -42.62 66.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.81 -29.2 32.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.319 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.478 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -62.71 -51.62 66.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.904 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.84 -29.24 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.483 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.08 72.3 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.215 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.423 ' CD2' HD11 ' A' ' 29' ' ' ILE . 59.4 t-80 -80.41 -29.48 37.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.63 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -67.01 -52.63 40.18 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.243 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.478 ' CE1' HD13 ' A' ' 150' ' ' ILE . 44.2 t80 -63.3 -49.29 74.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.55 HD11 ' CE1' ' A' ' 16' ' ' PHE . 78.7 mt -57.26 -32.93 67.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.838 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -70.32 -16.64 63.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.8 0.333 . . . . 0.0 110.946 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.06 -7.98 50.28 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.513 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.478 HD13 ' CE1' ' A' ' 146' ' ' PHE . 0.9 OUTLIER -91.07 -139.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -152.07 -53.06 0.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -168.1 -174.94 2.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.828 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.571 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.613 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.613 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 82.6 Cg_endo -72.42 175.52 9.95 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 124.356 3.37 . . . . 0.0 109.607 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.99 110.15 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.69 0.281 . . . . 0.0 110.884 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.16 174.76 21.54 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.558 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m 60.17 106.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.869 0.366 . . . . 0.0 110.911 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.37 130.05 41.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.596 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 70.12 165.2 0.27 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.168 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.485 ' CD1' ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -106.69 125.83 51.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.539 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' CD2' ' A' ' 49' ' ' HIS . 0.3 OUTLIER -79.09 115.58 18.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.099 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' ' O ' ' A' ' 95' ' ' THR . . . -126.78 160.65 30.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 87.4 m -152.01 123.49 7.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.696 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.577 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -114.69 177.59 17.56 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.016 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.453 HD11 ' CD1' ' A' ' 77' ' ' ILE . 0.7 OUTLIER -127.55 117.42 22.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.704 0.288 . . . . 0.0 111.44 -179.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.61 HG13 ' HB3' ' A' ' 98' ' ' TYR . 73.4 mt -83.95 91.37 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 17.3 mt -79.23 145.22 9.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.238 -178.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.597 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.8 p90 -148.37 121.95 9.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.849 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 121' ' ' TRP . 3.9 ttp180 -85.95 112.75 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.001 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -90.65 119.81 31.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.071 0.463 . . . . 0.0 111.439 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.2 160.52 30.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.745 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.54 -82.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.32 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.8 pp -123.92 149.67 60.44 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.0 111.59 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -65.28 167.57 16.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.739 2.292 . . . . 0.0 112.322 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -144.39 -75.78 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.001 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.3 m -74.67 -10.79 13.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.482 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.1 t0 69.74 25.47 5.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -109.89 -82.34 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.669 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -87.42 -175.68 5.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.189 179.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 178.88 -48.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.768 0.318 . . . . 0.0 111.469 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.597 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.5 mt -112.31 141.8 26.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 0.0 112.02 -179.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.729 ' HE2' ' HH ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -128.18 136.08 50.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.098 179.593 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.559 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 50.5 m-85 -95.66 154.37 17.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.53 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 56.2 tp -86.93 134.41 33.51 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.496 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.429 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.2 mt -135.94 140.23 43.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.3 mt -115.64 127.42 55.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.454 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -65.93 157.47 30.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.174 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.506 ' O ' ' OG ' ' A' ' 37' ' ' SER . . . -83.42 -14.63 52.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.721 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.506 ' OG ' ' O ' ' A' ' 36' ' ' ALA . 19.3 p 80.09 -32.18 0.13 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.852 0.461 . . . . 0.0 111.605 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.81 -166.47 2.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.696 0.284 . . . . 0.0 110.721 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.02 -127.16 40.19 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.436 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.511 ' O ' HG12 ' A' ' 40' ' ' ILE . 11.1 tt -86.67 -5.0 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 120.598 0.237 . . . . 0.0 111.341 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 65.0 33.23 9.86 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.839 0.352 . . . . 0.0 110.65 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' CD2' ' A' ' 42' ' ' HIS . 5.8 p-80 -62.79 134.51 56.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.598 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.488 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 41.7 m95 -101.68 129.97 47.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.3 p -149.06 143.97 17.57 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -56.16 159.61 12.25 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.313 2.009 . . . . 0.0 112.034 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.548 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 42.9 Cg_exo -57.83 88.9 0.05 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.684 2.256 . . . . 0.0 112.321 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.1 OUTLIER -104.64 156.21 18.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 111.319 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.45 -152.85 6.74 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.451 ' CD2' ' O ' ' A' ' 9' ' ' ARG . 9.8 t-80 -135.54 106.08 6.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.423 ' HA ' ' OG1' ' A' ' 59' ' ' THR . 1.5 p -78.64 129.45 37.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 121.146 0.498 . . . . 0.0 111.472 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.556 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 2.2 tt0 -91.21 153.54 44.64 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.148 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.556 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.8 Cg_endo -44.0 -38.46 10.35 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.108 2.538 . . . . 0.0 113.004 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.515 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.93 -4.16 63.49 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.982 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -91.32 154.6 19.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.723 0.261 . . . . 0.0 110.856 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.887 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 17.3 t70 -73.03 158.45 35.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.995 0.426 . . . . 0.0 110.104 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -74.58 -65.38 0.87 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.809 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.511 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 20.2 tp -59.71 -37.65 79.45 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.704 0.287 . . . . 0.0 110.754 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.887 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.1 mt-10 -50.27 -50.03 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.379 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 50' ' ' VAL . 20.7 m -54.7 -42.5 71.55 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.52 -32.33 69.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.887 178.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 95.0 mt -71.04 -52.31 20.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.312 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -61.77 -42.81 99.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.464 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -33.06 71.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.236 179.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 97.6 m -63.73 -49.28 73.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.36 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.549 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 12.3 pt20 -80.32 -23.26 40.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.716 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -79.0 -31.8 44.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.189 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -111.63 -14.6 13.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.625 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -130.69 -5.35 4.1 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.95 1.83 49.59 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.026 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.549 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.9 mt -104.11 125.33 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 CA-C-O 120.918 0.389 . . . . 0.0 110.619 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.1 pt-20 -105.69 168.38 9.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.522 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.47 -36.36 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.762 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.83 -22.44 76.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.99 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.447 ' HB3' HG22 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -93.21 -5.08 50.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.607 0.241 . . . . 0.0 111.191 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.21 -166.16 1.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.784 0.326 . . . . 0.0 110.376 178.764 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 90.3 m -139.33 97.85 3.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.513 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.453 ' CD1' HD11 ' A' ' 13' ' ' LEU . 11.1 mm -71.42 106.33 2.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.212 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.451 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.37 133.35 32.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.596 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.53 151.14 20.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.251 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -21.51 40.36 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.884 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.516 ' CD1' HD22 ' A' ' 100' ' ' LEU . 19.9 t80 -105.36 127.78 53.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.791 0.329 . . . . 0.0 111.496 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.417 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 6.7 ttpt -158.52 128.06 5.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.525 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.79 147.68 25.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.722 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.633 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.8 OUTLIER -128.27 138.04 52.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.189 0.518 . . . . 0.0 111.951 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.438 ' CD1' ' HB3' ' A' ' 135' ' ' GLU . 6.6 mt -99.45 124.75 44.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.122 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -114.21 124.76 52.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.32 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.571 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 30.1 p90 -167.49 146.87 5.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.097 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.483 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 11.0 p -89.55 107.68 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.721 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.434 ' HB2' " C4'" ' A' ' 154' ' ' ATP . . . -74.91 -101.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.563 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.47 -49.43 77.59 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-O 120.91 0.386 . . . . 0.0 110.579 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.07 27.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.187 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.483 ' N ' ' CG2' ' A' ' 88' ' ' VAL . 0.0 OUTLIER -154.59 131.43 5.94 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 120.931 0.396 . . . . 0.0 110.635 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.596 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 57.9 Cg_endo -69.33 120.0 6.9 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.56 2.84 . . . . 0.0 112.869 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.432 ' HG2' HD11 ' A' ' 8' ' ' LEU . 18.3 mtpp -105.05 128.29 53.26 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.098 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.403 ' O ' ' O ' ' A' ' 10' ' ' ALA . 41.4 m -95.5 109.12 21.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.633 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.5 t -106.82 108.51 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.592 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.73 128.27 39.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.61 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.8 m-85 -116.63 131.45 56.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -177.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.445 ' CD2' HD11 ' A' ' 57' ' ' LEU . 3.3 m-90 -116.36 155.86 27.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.248 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.516 HD22 ' CD1' ' A' ' 81' ' ' PHE . 2.6 mt -89.83 124.42 34.65 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.513 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -133.08 137.1 46.26 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.75 0.309 . . . . 0.0 110.812 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.521 ' HB2' ' CE1' ' A' ' 16' ' ' PHE . 13.8 tt0 -113.4 114.53 26.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.572 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.501 HG13 HD23 ' A' ' 75' ' ' LEU . 8.3 m -72.75 101.22 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 121.427 0.632 . . . . 0.0 110.311 179.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -9.64 0.85 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.417 -178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.835 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 9.8 m-20 -108.41 100.87 10.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.933 0.396 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.729 ' HH ' ' HE2' ' A' ' 30' ' ' GLU . 0.1 OUTLIER -52.27 -38.81 59.29 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.992 0.425 . . . . 0.0 110.574 -179.864 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.58 26.9 5.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.708 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.835 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.7 p -51.5 144.48 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.293 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -70.71 143.88 51.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.999 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.598 HG13 ' CE2' ' A' ' 119' ' ' TYR . 35.9 mm -121.7 98.97 6.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.461 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.04 103.14 15.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.85 -179.307 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 14.5 mt -91.81 173.18 8.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.03 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.9 p -117.15 -172.22 2.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -66.82 -12.49 59.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.668 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -90.7 -23.37 20.74 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.599 0.237 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.517 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.1 m80 -113.93 118.92 35.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.933 0.397 . . . . 0.0 110.878 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.435 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 22.4 tp60 -85.35 -22.32 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.382 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.33 -177.14 3.93 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.927 0.394 . . . . 0.0 111.497 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.598 ' CE2' HG13 ' A' ' 110' ' ' ILE . 44.5 p90 -148.96 174.4 12.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.441 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 7.3 mtt180 -157.07 149.54 23.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.267 0.556 . . . . 0.0 111.851 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.521 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 94.6 m95 -112.78 106.83 15.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.325 178.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.29 167.61 21.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.1 0.476 . . . . 0.0 111.677 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.8 -165.55 28.94 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.912 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.4 tp -64.54 -43.29 94.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.99 -53.8 54.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.51 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.699 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.48 -48.28 56.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.937 0.399 . . . . 0.0 110.1 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.429 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -52.81 -26.93 15.99 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.8 OUTLIER -82.97 -38.58 22.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.804 178.571 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.699 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -58.33 -45.2 88.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.844 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.623 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -78.71 -38.42 39.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.289 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.23 50.19 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.713 179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.433 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.43 -32.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.259 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.479 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 34.3 m-85 -59.9 119.69 8.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.773 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -46.48 -50.16 17.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.569 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.486 ' CD ' HN62 ' A' ' 154' ' ' ATP . 35.6 mp0 -48.25 -54.76 12.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.139 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.17 -44.0 97.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.752 0.31 . . . . 0.0 110.934 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.12 -39.28 27.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.158 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.527 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.7 -47.05 50.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.599 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.492 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -52.59 -46.72 67.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.322 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.45 -27.62 58.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.115 178.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.527 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.95 -51.8 55.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.209 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.454 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -73.79 -29.68 62.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.481 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.54 -50.32 66.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.757 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -70.25 -37.61 74.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.097 0.475 . . . . 0.0 110.077 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 45.9 tp60 -59.77 -52.49 65.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.245 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.477 ' CE1' HD12 ' A' ' 150' ' ' ILE . 59.6 t80 -55.08 -55.41 31.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.926 -179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.58 HD11 ' CE2' ' A' ' 16' ' ' PHE . 87.6 mt -58.56 -41.22 85.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.08 -12.96 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.691 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.86 -22.53 17.4 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.477 HD12 ' CE1' ' A' ' 146' ' ' PHE . 3.7 mt -72.32 -124.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.782 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 71.79 79.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.245 0.545 . . . . 0.0 110.957 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -79.06 -10.95 59.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.099 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.878 -179.899 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.571 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.532 0 N-CA-C 110.287 -1.125 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.28 112.47 3.45 Favored 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 124.36 3.374 . . . . 0.0 109.634 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 113.66 2.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.819 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -151.33 161.04 29.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.563 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.4 p -58.4 169.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.717 0.294 . . . . 0.0 111.082 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.04 122.95 14.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 58.96 167.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.098 0.475 . . . . 0.0 111.258 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.66 137.26 46.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.751 179.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.48 ' HB3' HG12 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -81.84 129.72 34.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.828 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -142.09 164.07 31.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.258 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 28.1 m -153.49 123.67 7.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.51 173.93 15.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.861 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -127.89 117.89 22.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.959 0.38 . . . . 0.0 111.336 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.523 HG13 ' HB3' ' A' ' 98' ' ' TYR . 65.8 mt -84.73 91.7 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 52.4 mt -81.99 145.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.33 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.642 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 42.9 p90 -148.98 121.41 8.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.776 -179.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.59 113.81 21.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.03 0.443 . . . . 0.0 110.688 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -90.42 108.39 19.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.025 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.24 155.71 39.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.372 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.427 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -59.95 -81.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.459 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.427 HG13 HD12 ' A' ' 20' ' ' LEU . 2.0 pp -108.68 149.11 39.03 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.911 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -74.16 157.77 45.98 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.693 2.262 . . . . 0.0 112.254 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.75 -78.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.678 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.8 t -101.91 11.48 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.555 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 61.47 47.75 6.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.959 0.409 . . . . 0.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -137.82 119.11 14.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 71.45 -69.48 0.18 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.04 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 69.64 -62.66 0.41 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.436 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.642 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.7 mt -87.29 154.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.569 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.461 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.3 mt-10 -135.63 125.06 24.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.508 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 52.0 m-85 -91.15 145.28 24.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.55 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.475 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.4 tp -85.09 138.93 32.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.05 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.4 mt -139.11 144.21 38.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.433 ' HB3' ' CG ' ' A' ' 116' ' ' HIS . 24.3 mt -122.69 107.23 11.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.752 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.3 tt0 -64.45 136.75 57.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.002 0.429 . . . . 0.0 111.314 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.18 150.3 34.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.819 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 p -89.83 19.13 4.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.1 t0 178.64 -163.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.43 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.95 -120.28 8.58 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.891 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.473 ' CG1' ' HB3' ' A' ' 42' ' ' HIS . 4.0 pt -101.15 9.31 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 64.78 22.72 12.6 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.419 0.628 . . . . 0.0 110.581 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.473 ' HB3' ' CG1' ' A' ' 40' ' ' ILE . 15.9 p-80 -65.9 163.27 17.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.225 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.518 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 30.1 m95 -113.15 142.86 45.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.248 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -158.86 138.54 8.56 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 170.41 2.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.547 2.164 . . . . 0.0 112.055 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.414 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 31.8 Cg_exo -58.81 99.79 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.58 2.186 . . . . 0.0 112.517 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.12 148.94 21.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.611 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -131.16 178.76 17.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.839 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -121.17 90.69 3.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.663 0.268 . . . . 0.0 110.728 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.487 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.3 p -71.26 132.99 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.007 0.432 . . . . 0.0 111.04 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.549 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.4 tt0 -96.8 151.72 38.01 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.854 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.549 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 2.6 Cg_endo -47.84 -30.32 13.06 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.864 2.376 . . . . 0.0 112.704 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.508 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -96.74 -9.7 56.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.525 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -87.65 162.17 17.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.492 0.187 . . . . 0.0 110.632 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.841 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 11.8 t70 -78.45 161.35 27.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.997 0.427 . . . . 0.0 110.346 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -74.24 -64.7 0.96 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.415 -179.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.454 ' HG ' HD12 ' A' ' 61' ' ' LEU . 10.6 tp -61.52 -40.14 93.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.226 -179.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.92 -50.08 58.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.61 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.487 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 99.5 m -55.34 -39.19 69.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.861 0.362 . . . . 0.0 110.144 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.77 -38.86 67.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.685 178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.454 HD12 ' HG ' ' A' ' 57' ' ' LEU . 82.9 mt -64.48 -52.91 55.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.518 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -43.78 97.42 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.47 -33.7 71.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.019 0.438 . . . . 0.0 110.156 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.43 HG23 ' CD1' ' A' ' 15' ' ' ILE . 23.8 m -60.53 -51.02 71.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.276 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.522 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 8.2 pt20 -77.76 -25.11 48.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.048 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -76.52 -32.66 58.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.08 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -114.92 -0.18 13.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.868 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.444 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -144.04 -8.54 0.7 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.465 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 74.12 -1.32 49.2 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.183 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.522 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 3.0 mt -103.06 126.1 57.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 117.034 0.417 . . . . 0.0 111.231 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.441 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.3 pt-20 -109.92 169.35 8.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.0 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.509 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.5 -36.81 24.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.356 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.53 -15.63 68.62 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.394 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.434 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 1.5 tp-100 -101.48 -11.85 19.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.638 0.256 . . . . 0.0 111.299 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.509 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.18 -171.5 2.43 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 121.021 0.438 . . . . 0.0 110.512 179.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.433 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 88.2 m -132.6 99.77 4.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.664 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 10.0 mm -71.63 120.52 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.191 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.1 mp -80.66 136.51 23.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -94.82 150.62 20.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.227 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.42 -18.5 55.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.867 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.457 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 14.3 t80 -109.74 128.06 55.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.874 0.368 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.427 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 130.93 7.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -153.57 140.7 19.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.56 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.585 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.2 pm0 -119.46 124.23 46.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.786 0.327 . . . . 0.0 111.08 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.3 mt -91.15 125.31 35.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.522 179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -118.03 121.42 40.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.487 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.41 ' CD2' ' OE2' ' A' ' 135' ' ' GLU . 22.9 p90 -167.11 142.66 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.81 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.457 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 7.8 p -77.63 112.56 15.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.398 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.408 ' CB ' " H4'" ' A' ' 154' ' ' ATP . . . -83.53 -98.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.528 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -43.23 98.26 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.915 0.388 . . . . 0.0 110.637 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.08 31.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.563 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -163.42 129.54 2.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.344 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.574 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 48.9 Cg_endo -66.81 119.41 6.43 Favored 'Trans proline' 0 CA--C 1.514 -0.523 0 C-N-CA 123.328 2.686 . . . . 0.0 112.912 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.465 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 1.2 mmmt -103.5 120.75 41.46 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.974 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.9 m -85.59 106.43 16.89 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.585 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 t -105.11 108.58 25.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.102 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.536 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.49 129.03 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.523 ' HB3' HG13 ' A' ' 14' ' ' ILE . 44.5 m-85 -117.61 158.34 24.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.431 0.634 . . . . 0.0 112.682 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.439 ' CD2' HD12 ' A' ' 57' ' ' LEU . 8.4 m-90 -143.73 150.61 38.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.889 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.457 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -86.22 121.33 28.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -129.81 147.19 51.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.122 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.9 OUTLIER -121.81 116.17 23.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.205 -179.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.502 HG11 ' CG2' ' A' ' 15' ' ' ILE . 10.0 m -76.02 116.27 18.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.302 0.572 . . . . 0.0 110.989 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -24.98 63.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.725 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.768 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 22.1 m-20 -99.29 112.76 24.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.142 0.496 . . . . 0.0 111.418 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -57.46 -45.64 84.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.181 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.26 25.19 5.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.861 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.768 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 3.2 p -43.92 145.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.004 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -66.35 142.1 57.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.294 0.568 . . . . 0.0 110.998 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.537 HG13 ' CE2' ' A' ' 119' ' ' TYR . 36.6 mm -121.75 98.15 5.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.465 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.9 OUTLIER -101.16 101.83 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.999 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.418 HD22 HG23 ' A' ' 110' ' ' ILE . 12.8 mt -87.9 173.15 9.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.159 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.3 -167.07 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.989 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -68.68 -14.07 62.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.403 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.03 -17.87 31.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.692 0.282 . . . . 0.0 111.427 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.433 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 90.2 m-70 -130.17 129.63 43.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.785 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -21.26 18.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.701 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.78 -177.66 6.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.989 0.424 . . . . 0.0 111.643 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.537 ' CE2' HG13 ' A' ' 110' ' ' ILE . 43.1 p90 -156.46 169.19 25.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.468 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.45 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -160.86 154.64 22.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 111.569 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.415 ' CH2' HG23 ' A' ' 103' ' ' VAL . 93.2 m95 -111.12 107.44 16.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.632 178.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -134.12 168.35 19.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.378 -178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.16 -152.53 5.91 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.946 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 9.1 tp -77.11 -45.8 25.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.853 0.327 . . . . 0.0 111.334 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -58.04 -48.97 78.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.593 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.749 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.46 -48.98 36.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.881 0.372 . . . . 0.0 110.514 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.434 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.15 -30.11 35.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.326 0.584 . . . . 0.0 109.772 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.65 -32.79 25.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.408 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.749 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.0 -42.13 97.27 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.461 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.604 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -78.28 -41.67 33.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.359 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.401 ' HB3' ' HB2' ' A' ' 136' ' ' MET . . . -76.7 55.97 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.726 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.474 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.32 -33.14 0.09 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.549 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 21.1 m-85 -57.69 113.36 1.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.59 -41.2 14.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.392 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.478 ' HE2' ' HD2' ' A' ' 133' ' ' PHE . 1.6 mp0 -55.01 -51.53 65.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.185 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.447 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.85 -44.79 95.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.67 -39.51 36.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.965 0.412 . . . . 0.0 109.915 179.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.555 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.43 -45.55 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.543 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -51.77 -44.32 63.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.173 0.511 . . . . 0.0 110.215 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.04 -28.18 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.224 179.194 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.555 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.04 -51.99 53.14 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.81 -29.98 68.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.21 -57.02 21.26 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.807 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 2.7 t-160 -67.87 -33.1 74.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.762 0.315 . . . . 0.0 110.262 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -63.02 -52.55 62.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.47 ' CE1' HD13 ' A' ' 150' ' ' ILE . 46.2 t80 -64.33 -47.68 78.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.458 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.531 HD13 ' CE2' ' A' ' 16' ' ' PHE . 45.1 mt -57.31 -28.72 63.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.443 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -80.38 -14.16 58.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.931 0.396 . . . . 0.0 110.425 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 69.3 m -92.22 -11.82 34.34 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.283 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.47 HD13 ' CE1' ' A' ' 146' ' ' PHE . 0.9 OUTLIER -84.78 -136.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -160.71 -71.65 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.75 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 178.14 90.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.964 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.901 -179.835 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.549 ' C8 ' ' CZ ' ' A' ' 133' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.531 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -72.4 105.93 1.97 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 124.26 3.307 . . . . 0.0 109.539 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.95 -21.91 14.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.48 -164.06 27.83 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.431 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.44 31.34 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.844 0.355 . . . . 0.0 110.793 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.25 129.94 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.724 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 65.02 166.95 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.315 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.593 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -105.66 140.18 39.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.453 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.82 131.69 35.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.132 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -144.26 165.09 28.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 18.7 m -155.88 123.59 5.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.183 0.516 . . . . 0.0 111.418 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.55 175.45 16.15 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.586 178.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.445 ' HA ' HD21 ' A' ' 13' ' ' LEU . 1.0 OUTLIER -130.92 117.53 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.153 0.476 . . . . 0.0 111.518 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 98' ' ' TYR . 44.9 mt -84.33 91.27 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.598 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 21.2 mt -79.01 146.11 8.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.856 -1.065 . . . . 0.0 111.686 -177.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.741 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.2 p90 -152.48 122.9 7.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.568 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.77 113.76 19.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.647 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.401 ' CB ' ' HG3' ' A' ' 102' ' ' GLU . 22.8 ttm180 -94.12 116.52 28.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.313 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 89.7 m -74.8 159.4 31.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.593 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -82.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.964 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.442 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 1.9 pp -112.69 147.06 36.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.689 0.281 . . . . 0.0 111.158 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 5.4 Cg_exo -79.37 160.67 25.85 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.014 2.476 . . . . 0.0 112.205 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.79 -77.94 0.6 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.152 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.5 t -95.09 -9.49 9.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.166 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.47 31.71 1.3 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.866 0.365 . . . . 0.0 110.713 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -61.59 -85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.992 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -118.83 -39.44 2.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.968 0.413 . . . . 0.0 110.206 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 70.37 -56.62 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.724 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.741 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.6 mt -102.47 151.03 6.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.116 0.484 . . . . 0.0 111.943 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.545 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 2.3 mt-10 -137.76 129.57 28.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.821 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.2 m-85 -91.91 148.86 21.89 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.544 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 46.4 tp -85.15 137.08 33.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.925 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.463 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.6 mt -137.13 138.31 40.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.368 . . . . 0.0 111.057 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.42 HD11 ' CD2' ' A' ' 116' ' ' HIS . 11.1 mt -118.21 119.08 33.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.642 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.462 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 40.9 tt0 -82.48 133.84 35.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.538 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.77 149.42 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.787 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.3 OUTLIER -89.0 14.45 10.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.901 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -170.15 -176.89 2.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.42 . . . . 0.0 111.056 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 67.39 -133.17 30.42 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.569 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.527 ' O ' HG12 ' A' ' 40' ' ' ILE . 10.4 tt -81.65 -0.56 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.681 0.277 . . . . 0.0 111.432 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 59.35 33.38 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.869 0.366 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -60.63 156.0 17.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.974 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.512 ' CG ' ' HB3' ' A' ' 130' ' ' LEU . 78.1 m95 -104.32 131.8 51.25 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.936 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.417 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.8 OUTLIER -158.07 156.31 27.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.959 -179.791 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.8 176.89 9.42 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.378 2.052 . . . . 0.0 111.984 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.446 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 39.2 Cg_exo -60.58 114.58 2.2 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.535 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -103.61 142.35 34.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.047 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -132.62 172.52 21.23 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.235 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -120.9 95.13 4.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.814 0.34 . . . . 0.0 111.122 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.44 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 1.9 p -70.1 132.25 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.618 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.5 tt0 -96.98 152.4 38.32 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.85 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.549 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.1 Cg_endo -45.12 -33.99 8.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.018 2.479 . . . . 0.0 112.866 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.618 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.37 -10.42 59.41 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.594 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -86.45 168.0 14.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.608 0.242 . . . . 0.0 110.795 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.841 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.5 t70 -85.95 161.37 19.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 110.698 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.448 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -73.67 -65.67 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.867 -179.389 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.498 HD11 ' CD2' ' A' ' 99' ' ' TRP . 22.2 tp -62.28 -38.94 91.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.307 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.88 -50.17 57.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.468 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.433 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 61.4 m -54.64 -38.98 67.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -74.07 -31.11 62.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.043 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.441 HD11 ' HG ' ' A' ' 57' ' ' LEU . 82.5 mt -74.18 -53.04 10.67 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.882 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -60.36 -42.96 96.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.542 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -33.82 71.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 0.0 110.038 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.484 HG21 ' CD1' ' A' ' 15' ' ' ILE . 32.7 m -62.45 -54.24 43.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.586 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -71.56 -21.16 61.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.165 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.61 -42.64 24.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.743 0.306 . . . . 0.0 111.017 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -105.49 6.16 32.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.637 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.447 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -148.61 -8.59 0.37 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.434 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 70.88 0.92 36.44 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.233 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.561 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -104.23 121.43 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-O 120.968 0.414 . . . . 0.0 110.778 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.426 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.3 pm0 -104.89 169.35 8.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.48 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -52.54 -26.78 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 110.705 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.416 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -75.05 -11.1 84.16 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.108 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.444 ' CG ' HG22 ' A' ' 70' ' ' ILE . 70.0 tp60 -110.58 -16.07 13.73 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.455 0.169 . . . . 0.0 111.102 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.487 ' CD2' HG23 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -119.55 -170.17 1.89 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.935 0.397 . . . . 0.0 110.512 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.481 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 60.4 m -136.36 102.13 4.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.172 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.553 HD12 ' HB2' ' A' ' 101' ' ' ALA . 9.7 mm -74.11 124.31 31.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.286 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.49 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.95 136.04 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.281 0.562 . . . . 0.0 111.273 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -96.31 147.83 23.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.61 -29.59 11.17 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.478 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 20.0 t80 -102.95 129.79 49.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.76 0.314 . . . . 0.0 110.886 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.56 129.05 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.413 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -149.15 136.01 19.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.133 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.674 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 3.0 pm0 -122.31 127.79 50.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.952 0.406 . . . . 0.0 111.24 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.599 HD13 ' HE2' ' A' ' 98' ' ' TYR . 6.1 mt -91.84 120.66 32.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.499 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -109.84 124.47 51.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.597 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.581 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 23.5 p90 -166.83 144.3 4.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.814 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.482 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 9.7 p -85.15 108.88 17.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.909 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.409 ' HB1' H5'2 ' A' ' 154' ' ' ATP . . . -78.94 -97.93 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.158 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -62.28 -50.09 73.06 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.861 0.363 . . . . 0.0 110.682 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -175.1 29.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.244 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.593 ' HB3' HD13 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -161.69 130.45 3.03 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.515 179.47 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.574 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 51.3 Cg_endo -68.32 117.8 5.2 Favored 'Trans proline' 0 CA--C 1.518 -0.313 0 C-N-CA 123.204 2.603 . . . . 0.0 112.789 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.466 ' HG2' HD11 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -100.98 117.35 34.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.86 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 54.7 m -80.75 112.54 18.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.674 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.6 t -110.47 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.656 -178.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.612 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.0 130.24 36.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.599 ' HE2' HD13 ' A' ' 85' ' ' LEU . 9.5 m-85 -115.52 128.81 56.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.025 0.441 . . . . 0.0 112.089 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.498 ' CD2' HD11 ' A' ' 57' ' ' LEU . 4.2 m-90 -116.36 146.82 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.097 178.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.478 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -83.46 113.97 21.14 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.36 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.553 ' HB2' HD12 ' A' ' 77' ' ' ILE . . . -121.58 147.01 46.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.916 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.563 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tm-20 -123.0 115.45 21.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.337 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.551 HG11 ' CG2' ' A' ' 15' ' ' ILE . 10.7 m -73.27 122.99 27.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.243 0.544 . . . . 0.0 110.499 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.416 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 2.5 mttt -59.94 -26.31 65.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.847 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.649 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 54.1 t0 -105.81 125.69 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 111.828 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -41.09 99.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.283 0.563 . . . . 0.0 109.645 179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -100.03 24.13 8.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.541 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.649 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 3.5 p -40.93 152.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.215 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.667 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 3.0 pm0 -62.16 139.81 58.45 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.331 0.586 . . . . 0.0 111.161 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.582 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.6 mm -124.52 96.95 4.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.705 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.667 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -101.6 99.67 9.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.436 -178.702 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.536 HD22 ' CG2' ' A' ' 110' ' ' ILE . 12.9 mt -92.82 161.18 14.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.912 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -113.57 -169.24 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.389 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -65.99 -13.96 60.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.225 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -84.97 -18.97 32.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.038 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 34' ' ' LEU . 63.1 m-70 -134.3 109.65 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.726 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.787 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 6.7 pt20 -88.99 2.13 54.45 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.0 160.61 6.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.062 0.458 . . . . 0.0 111.673 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.582 ' CE2' HG13 ' A' ' 110' ' ' ILE . 40.2 p90 -140.13 173.02 11.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.51 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.422 ' CZ ' HD23 ' A' ' 122' ' ' LEU . 28.4 mtp180 -157.14 156.31 32.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.217 0.532 . . . . 0.0 111.967 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.433 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.3 m95 -122.35 107.13 11.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.471 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.676 HD12 ' CD1' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -139.33 172.15 13.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.064 0.459 . . . . 0.0 111.794 -178.322 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.82 -154.5 7.93 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.956 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.5 tp -76.39 -41.83 46.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.745 0.307 . . . . 0.0 111.291 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.9 pt-20 -61.21 -50.3 73.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.404 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.805 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.29 -42.67 65.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.715 -179.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.463 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.58 -30.6 68.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.9 m -82.45 -35.75 27.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.805 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -61.37 -43.17 99.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.78 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.676 ' CD1' HD12 ' A' ' 122' ' ' LEU . 1.5 mt -77.6 -44.7 27.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.002 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.99 56.1 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.017 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.91 -34.92 0.17 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.186 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.411 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 9.8 m-85 -53.36 114.87 1.64 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.4 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.36 -50.18 12.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.28 -179.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.508 ' HB3' ' CD1' ' A' ' 85' ' ' LEU . 23.7 mp0 -48.14 -53.1 17.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.516 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.11 -47.25 85.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.324 -179.087 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.5 -40.41 37.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.958 0.409 . . . . 0.0 110.352 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.548 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.91 -47.86 60.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.945 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.414 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -52.11 -44.31 64.38 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.241 0.543 . . . . 0.0 109.919 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.88 -27.3 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.078 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.548 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.82 -52.41 37.2 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.01 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.74 -28.89 62.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.441 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.474 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.21 -40.77 97.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.65 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.42 ' CD2' HD11 ' A' ' 29' ' ' ILE . 1.2 t-160 -79.0 -27.39 43.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.033 0.444 . . . . 0.0 110.466 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -73.46 -52.49 13.47 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.269 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.481 ' CE1' HD13 ' A' ' 150' ' ' ILE . 50.4 t80 -58.97 -52.2 66.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.138 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.678 HD12 ' CZ ' ' A' ' 16' ' ' PHE . 74.5 mt -53.99 -42.81 69.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.449 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -13.03 60.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.478 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.71 -15.82 26.23 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.48 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.481 HD13 ' CE1' ' A' ' 146' ' ' PHE . 1.2 mt -80.97 -133.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -161.44 -69.65 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 110.623 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -157.7 -14.97 0.08 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.976 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.334 -0.106 0 CA-C-N 116.915 -0.13 . . . . 0.0 110.829 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.581 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.806 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.529 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.806 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 83.0 Cg_endo -72.4 95.69 0.79 Allowed 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 124.307 3.338 . . . . 0.0 109.586 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.07 123.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.02 0.438 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.65 -25.14 1.06 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.412 ' HB3' ' HD2' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -167.78 104.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.816 0.341 . . . . 0.0 110.699 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.581 ' O ' ' HG2' ' A' ' 6' ' ' MET . 0.0 OUTLIER -92.7 51.52 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.263 0.554 . . . . 0.0 111.07 -179.586 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 73.56 162.2 0.26 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.877 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -105.41 130.14 53.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.651 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.438 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.44 120.79 25.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.446 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.02 170.92 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.411 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.2 m -159.58 123.98 3.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 111.098 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.504 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.73 178.97 19.12 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.765 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.696 HD21 ' HB3' ' A' ' 101' ' ' ALA . 1.1 mt -133.6 118.02 17.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.969 0.385 . . . . 0.0 111.469 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.616 HG13 ' HB3' ' A' ' 98' ' ' TYR . 51.2 mt -87.52 91.64 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.805 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.549 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 20.1 mt -78.12 146.29 8.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.587 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.65 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 35.9 p90 -150.04 123.24 8.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -81.66 113.07 19.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.32 127.82 35.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.96 0.409 . . . . 0.0 112.046 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -92.99 159.73 15.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.217 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -81.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.663 0.268 . . . . 0.0 110.699 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 1.6 pp -107.55 150.34 39.99 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.229 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 6.2 Cg_exo -73.87 164.78 33.77 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.814 2.343 . . . . 0.0 112.39 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.11 -76.56 0.57 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.73 179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 11.6 t -86.11 -8.23 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.6 5.14 2.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.153 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -95.2 -70.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.134 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 62.6 m-20 -89.63 -179.24 5.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.995 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 176.54 -43.86 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.947 0.403 . . . . 0.0 110.946 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.65 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -117.2 140.98 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.433 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.3 mp0 -126.91 138.51 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.889 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 49.8 m-85 -100.59 152.24 20.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.97 0.414 . . . . 0.0 112.05 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.486 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 53.0 tp -84.02 134.37 34.63 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.774 178.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.515 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.6 mt -132.62 142.41 49.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.863 0.363 . . . . 0.0 110.951 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.482 HD13 ' HG3' ' A' ' 46' ' ' PRO . 3.4 mt -123.11 104.92 9.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.891 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.466 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 3.1 tt0 -59.88 133.68 56.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.24 147.41 13.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 88.6 p -80.64 2.69 24.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.738 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -175.09 174.1 2.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 110.942 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 86.19 -131.94 10.83 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.652 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.539 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.3 tt -81.31 1.02 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.783 0.325 . . . . 0.0 111.501 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 64.08 29.11 14.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.898 0.38 . . . . 0.0 110.279 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -64.98 146.48 54.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.603 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.541 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 63.7 m95 -97.38 130.52 44.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.173 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.62 136.37 10.02 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.405 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 18.2 Cg_endo -57.37 179.91 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.866 2.377 . . . . 0.0 112.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.482 ' HG3' HD13 ' A' ' 34' ' ' LEU . 21.7 Cg_exo -63.91 117.09 4.11 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.644 2.229 . . . . 0.0 112.543 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.82 128.91 55.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.408 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.36 173.37 14.72 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.351 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -109.99 103.63 12.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.914 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.502 ' HA ' ' OG1' ' A' ' 59' ' ' THR . 2.1 p -86.7 121.91 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.919 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.52 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 1.5 tt0 -93.73 154.01 41.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.971 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.52 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 3.4 Cg_exo -42.4 -46.44 7.72 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.745 2.297 . . . . 0.0 112.35 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.64 -11.46 82.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.107 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -85.29 164.33 18.08 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.855 0.327 . . . . 0.0 110.969 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.821 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 25.1 t70 -85.08 159.24 20.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.208 0.528 . . . . 0.0 110.772 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -71.42 -66.42 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.481 HD11 ' CD2' ' A' ' 99' ' ' TRP . 12.1 tp -59.23 -40.44 85.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.279 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.821 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.85 -50.54 45.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.856 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.502 ' OG1' ' HA ' ' A' ' 50' ' ' VAL . 24.3 m -55.47 -36.05 66.18 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HB3' ' HG ' ' A' ' 13' ' ' LEU . . . -75.84 -32.67 59.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.758 178.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.7 mt -73.37 -53.28 11.13 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.044 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -57.9 -43.66 86.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.147 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.79 -34.66 73.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.582 179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.444 HG22 ' CD1' ' A' ' 15' ' ' ILE . 28.4 m -59.39 -53.63 55.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.521 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.506 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 4.9 pt20 -74.12 -21.44 59.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.17 -35.82 41.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 110.968 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -112.24 6.63 19.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.85 -179.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.506 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -151.49 -12.15 0.21 Allowed 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.483 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 77.64 -2.76 62.24 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.29 -0.957 . . . . 0.0 112.784 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.506 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.9 mt -100.38 124.77 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.905 0.384 . . . . 0.0 110.831 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -108.58 167.05 10.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.767 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.515 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -45.85 -38.54 7.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.648 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.38 -20.53 73.56 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.241 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.423 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.5 tp60 -96.59 -5.68 38.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.519 0.199 . . . . 0.0 111.021 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.515 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.08 -168.81 2.15 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.906 0.384 . . . . 0.0 110.369 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.473 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 87.7 m -137.11 100.74 4.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.654 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.46 HD13 HD23 ' A' ' 61' ' ' LEU . 8.1 mm -72.94 125.27 31.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.962 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.483 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.62 133.38 29.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.292 0.568 . . . . 0.0 111.41 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.16 151.92 20.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.205 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 99.76 -22.24 41.33 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.657 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.488 ' CD1' ' CD2' ' A' ' 100' ' ' LEU . 14.2 t80 -106.03 131.7 53.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 110.911 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.481 ' HD2' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.25 131.92 8.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.232 0.539 . . . . 0.0 111.109 179.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -159.39 139.32 11.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.081 179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.656 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.4 OUTLIER -126.39 134.27 51.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.913 0.387 . . . . 0.0 111.359 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.4 mt -93.18 118.74 31.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.98 125.67 53.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.858 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.609 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 22.2 p90 -166.85 142.67 4.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.844 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 7.4 p -81.73 112.34 19.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.019 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.4 -107.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -35.84 78.92 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.928 0.394 . . . . 0.0 110.748 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.93 28.55 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.857 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.643 ' HB3' HD12 ' A' ' 8' ' ' LEU . 1.9 tppt? -158.53 125.95 2.69 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.99 0.424 . . . . 0.0 111.321 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.607 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 58.2 Cg_endo -70.16 116.59 4.67 Favored 'Trans proline' 0 CA--C 1.513 -0.555 0 C-N-CA 123.358 2.706 . . . . 0.0 113.096 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.498 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -99.84 123.17 43.82 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.267 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.3 m -88.6 114.18 24.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.656 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.0 t -112.85 108.19 24.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.901 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.594 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.29 128.6 39.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.616 ' HB3' HG13 ' A' ' 14' ' ' ILE . 20.3 m-85 -117.95 128.58 54.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.241 0.543 . . . . 0.0 112.269 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.481 ' NE1' ' HD2' ' A' ' 82' ' ' LYS . 17.7 m-90 -109.99 167.48 10.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.579 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.488 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -103.03 110.91 23.0 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.537 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.696 ' HB3' HD21 ' A' ' 13' ' ' LEU . . . -118.23 154.49 32.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.465 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.9 tt0 -130.97 115.24 16.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.484 HG13 HD21 ' A' ' 75' ' ' LEU . 5.3 m -73.97 122.2 26.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 121.345 0.593 . . . . 0.0 111.273 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -24.12 66.25 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.166 -178.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.751 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.5 t0 -104.44 117.9 35.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.081 0.467 . . . . 0.0 112.041 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -57.62 -42.81 84.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.0 25.24 8.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.904 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.751 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -44.06 142.54 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.869 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -63.53 142.45 58.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.252 0.549 . . . . 0.0 111.422 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.532 HG13 ' CE2' ' A' ' 119' ' ' TYR . 36.5 mm -121.05 97.4 4.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.503 179.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.483 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 8.3 mtp180 -102.17 101.69 12.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.88 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.459 HD23 ' CG2' ' A' ' 110' ' ' ILE . 10.1 mt -90.73 178.72 5.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.353 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.66 -158.27 0.85 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.996 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -78.73 -3.45 44.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.4 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.78 -22.47 20.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.657 0.265 . . . . 0.0 111.104 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.37 116.71 17.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.41 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -87.57 -3.49 58.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.913 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -168.72 164.37 12.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 0.0 111.4 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.532 ' CE2' HG13 ' A' ' 110' ' ' ILE . 41.0 p90 -141.33 168.12 20.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.625 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.425 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 6.1 mtt180 -156.45 159.76 38.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.452 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.448 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.1 m95 -124.26 107.64 11.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.638 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.466 ' CD1' ' CD1' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -136.33 172.74 12.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.98 0.419 . . . . 0.0 111.342 -178.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.56 -153.99 7.29 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.959 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.9 tp -77.21 -42.41 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.649 0.261 . . . . 0.0 111.157 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.5 pt-20 -60.81 -50.08 74.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.316 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.769 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.22 -46.9 54.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.651 -179.401 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.515 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.03 -30.65 48.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.414 0.626 . . . . 0.0 109.636 178.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 6.5 m -83.71 -34.45 24.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.52 179.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.769 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.04 -41.44 99.5 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 121.091 0.472 . . . . 0.0 109.938 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.59 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.1 mt -77.89 -45.88 22.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.129 179.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.0 53.74 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.402 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.18 -31.49 0.05 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.585 -179.571 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.403 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 8.9 m-85 -57.19 115.94 2.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.13 0.49 . . . . 0.0 110.412 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.85 -40.01 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.473 -179.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.496 ' CD ' HN62 ' A' ' 154' ' ' ATP . 41.8 mp0 -58.1 -54.08 50.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.72 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.54 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -63.42 -39.65 95.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.749 0.309 . . . . 0.0 110.489 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.413 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.79 -37.95 60.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.19 -46.01 36.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.946 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.424 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.25 -45.98 62.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.211 0.529 . . . . 0.0 110.314 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.52 -29.78 59.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.045 179.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.54 -51.33 60.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.792 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.56 -29.67 67.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.61 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.8 -44.94 94.04 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.986 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -78.78 -30.81 45.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -64.76 -52.36 57.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.409 ' CD2' HD12 ' A' ' 150' ' ' ILE . 84.6 t80 -61.56 -53.55 54.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.819 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.562 HD13 ' CE2' ' A' ' 16' ' ' PHE . 96.7 mt -56.02 -24.79 41.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.574 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.61 -10.93 56.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.532 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.3 t -97.14 -18.49 19.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.871 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.499 HG13 ' HA ' ' A' ' 147' ' ' LEU . 0.8 OUTLIER -74.03 -129.27 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.023 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.424 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 2.6 tt0 -160.14 -64.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.821 0.343 . . . . 0.0 111.018 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -158.28 -41.15 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.22 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.609 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.55 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.731 ' HG2' ' H ' ' A' ' 3' ' ' LEU . 83.3 Cg_endo -72.39 -77.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 124.357 3.371 . . . . 0.0 109.634 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.731 ' H ' ' HG2' ' A' ' 2' ' ' PRO . 5.6 mt -65.83 112.9 3.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.832 0.348 . . . . 0.0 110.863 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -144.41 69.59 0.4 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.573 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -75.4 129.4 37.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.853 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.1 tpt -77.75 131.1 37.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.05 0.452 . . . . 0.0 111.011 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.801 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . -58.77 158.28 8.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.696 0.76 . . . . 0.0 112.124 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.604 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -116.29 145.99 42.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.132 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.559 HH21 ' HD2' ' A' ' 56' ' ' ASP . 1.3 ttt85 -78.82 118.92 21.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.592 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.476 ' HB2' HG23 ' A' ' 96' ' ' VAL . . . -127.3 166.64 17.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.058 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.9 m -159.24 123.84 4.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.078 0.466 . . . . 0.0 111.762 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -120.61 171.92 14.87 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.496 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' A' ' 77' ' ' ILE . 0.6 OUTLIER -125.36 118.18 25.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 117.07 0.435 . . . . 0.0 111.976 -179.171 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.737 HG13 ' HB3' ' A' ' 98' ' ' TYR . 48.6 mt -86.24 91.74 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 30.3 mt -78.88 142.82 13.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.049 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.686 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.0 p90 -145.52 121.33 10.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.329 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 106' ' ' TYR . 20.3 tpt180 -81.0 113.34 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.916 0.389 . . . . 0.0 110.075 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.15 125.26 38.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.666 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.22 157.0 16.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.005 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.36 -80.9 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.724 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 pp -110.25 152.15 43.03 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.595 0.236 . . . . 0.0 111.13 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.12 156.72 38.12 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.787 2.325 . . . . 0.0 112.371 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 -78.49 0.59 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.2 t -107.75 9.57 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.448 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 60.15 27.81 17.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.79 0.328 . . . . 0.0 110.817 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -107.34 -33.17 7.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.727 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -166.22 120.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.751 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -106.79 -37.64 6.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.203 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.686 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.5 mt -115.93 141.61 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.976 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.549 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -128.84 141.77 51.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.991 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.58 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.7 m-85 -103.52 145.41 30.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.979 0.419 . . . . 0.0 111.843 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.564 HD21 HD13 ' A' ' 15' ' ' ILE . 52.1 tp -78.2 135.41 37.61 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.112 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.2 mt -134.23 145.4 49.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.002 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.485 HD13 ' CE1' ' A' ' 116' ' ' HIS . 6.6 mt -123.16 113.46 18.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.088 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.454 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.0 tt0 -76.64 147.69 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.559 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.02 150.37 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.092 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.426 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 90.8 p -82.57 1.63 37.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.497 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -174.88 -166.32 0.23 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.886 0.375 . . . . 0.0 110.997 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.44 -120.62 9.31 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.806 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.464 ' O ' HG12 ' A' ' 40' ' ' ILE . 16.2 tt -94.55 -2.25 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.705 0.288 . . . . 0.0 111.49 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 60.97 33.46 19.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.115 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -68.81 150.35 47.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.631 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.495 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 65.7 m95 -102.12 135.02 44.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.8 153.38 27.47 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.6 172.88 15.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.73 2.287 . . . . 0.0 112.42 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.491 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 15.9 Cg_exo -66.11 86.58 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.617 2.211 . . . . 0.0 112.463 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.449 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 3.6 pttt -99.95 146.75 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.935 0.397 . . . . 0.0 110.892 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.28 -173.78 13.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.603 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 m80 -112.95 99.19 7.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.643 0.259 . . . . 0.0 110.72 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.497 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.4 p -67.01 130.54 32.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.048 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' HG2' ' N ' ' A' ' 52' ' ' PRO . 2.0 tt0 -96.93 151.11 37.56 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.243 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.443 ' N ' ' HG2' ' A' ' 51' ' ' GLU . 82.2 Cg_exo -39.63 -62.36 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.818 2.345 . . . . 0.0 112.463 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.31 -19.0 63.74 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.535 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -79.96 158.92 26.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.799 0.333 . . . . 0.0 110.657 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.864 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 6.0 t70 -83.33 163.26 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.289 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.559 ' HD2' HH21 ' A' ' 9' ' ' ARG . 0.8 OUTLIER -71.86 -64.39 0.94 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.154 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.552 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 26.5 tp -62.3 -42.88 99.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.418 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.864 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -49.15 -45.68 44.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.758 0.314 . . . . 0.0 110.497 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.497 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 84.9 m -55.81 -45.19 78.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.125 0.488 . . . . 0.0 109.889 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.51 -28.87 65.29 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.22 178.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 87.6 mt -72.78 -52.46 14.9 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.056 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -57.17 -46.89 82.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.779 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.03 -33.93 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 0.0 110.224 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.516 HG22 ' CD1' ' A' ' 15' ' ' ILE . 34.0 m -60.13 -52.31 65.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.506 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.509 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -79.19 -22.89 44.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.305 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -78.72 -36.63 43.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.688 0.28 . . . . 0.0 111.207 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 4.5 mm-40 -103.21 -18.09 15.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.721 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.48 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -125.04 -11.92 7.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.63 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 82.24 -10.78 52.8 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 119.85 -1.167 . . . . 0.0 112.423 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.509 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.5 mt -96.6 122.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 21.0 pm0 -105.64 171.53 7.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.088 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.516 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.59 -34.79 18.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.459 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -16.09 77.32 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.4 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.438 ' HB3' HG22 ' A' ' 70' ' ' ILE . 5.2 mm-40 -100.12 -10.57 21.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.547 0.213 . . . . 0.0 110.88 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.54 HD22 HG11 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -127.32 -169.4 2.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.85 0.357 . . . . 0.0 110.276 179.286 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.9 m -135.76 100.64 4.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.114 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.456 HD13 HD21 ' A' ' 61' ' ' LEU . 11.3 mm -74.13 114.17 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.12 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.539 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -78.19 138.68 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 121.09 0.471 . . . . 0.0 110.826 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -95.54 149.4 21.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.0 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.22 -22.07 33.9 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.247 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.54 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 21.2 t80 -106.64 127.82 53.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.767 0.317 . . . . 0.0 111.16 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.405 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.94 127.88 6.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 111.73 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -151.74 138.61 18.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.8 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.692 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -119.8 123.62 44.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.946 0.403 . . . . 0.0 111.481 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 9.0 mt -91.08 116.19 28.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.654 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.9 p30 -117.06 130.54 56.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.125 0.488 . . . . 0.0 110.719 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.567 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 18.4 p90 -166.86 139.24 3.52 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.795 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.81 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 8.7 p -81.1 116.14 24.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.34 0.591 . . . . 0.0 111.259 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.447 ' HB2' " H4'" ' A' ' 154' ' ' ATP . . . -73.63 -92.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.066 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -46.08 13.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.943 0.402 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -166.7 23.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.545 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.447 ' N ' ' CG2' ' A' ' 88' ' ' VAL . 0.2 OUTLIER -155.77 125.66 3.26 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.707 179.804 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.81 ' HA ' ' HA ' ' A' ' 88' ' ' VAL . 39.6 Cg_endo -68.37 -173.79 0.59 Allowed 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.137 1.892 . . . . 0.0 111.649 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -160.56 112.53 1.94 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.353 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.449 ' O ' ' N ' ' A' ' 10' ' ' ALA . 89.3 m -86.89 100.93 12.92 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.692 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 47.9 t -103.51 108.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.742 -178.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.638 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.22 123.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.737 ' HB3' HG13 ' A' ' 14' ' ' ILE . 29.8 m-85 -109.79 129.02 55.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.366 0.603 . . . . 0.0 112.579 -177.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.527 ' CD2' HD13 ' A' ' 57' ' ' LEU . 7.0 m-90 -115.16 149.59 37.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.985 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.512 HD22 ' CE1' ' A' ' 81' ' ' PHE . 4.0 mt -82.83 121.88 27.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.558 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -130.57 135.54 48.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.5 tt0 -113.59 117.48 31.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.71 0.29 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.54 HG11 HD22 ' A' ' 75' ' ' LEU . 6.4 m -74.79 112.81 12.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.361 0.601 . . . . 0.0 110.579 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -25.78 42.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.802 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.762 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 64.0 t0 -101.06 116.41 32.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.991 0.424 . . . . 0.0 111.101 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.434 ' CD1' ' HG2' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -61.82 -42.31 98.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.105 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.49 21.37 9.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.874 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.762 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.4 p -44.57 143.05 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.243 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.6 pm0 -65.26 146.04 55.45 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.406 0.622 . . . . 0.0 111.221 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.571 HG13 ' CE2' ' A' ' 119' ' ' TYR . 40.1 mm -123.83 98.58 5.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.293 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.63 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 8.9 mtt-85 -96.88 105.78 17.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.426 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.421 HD23 ' O ' ' A' ' 67' ' ' GLU . 9.0 mt -99.63 120.87 40.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.958 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.28 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.658 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -87.63 19.36 3.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.612 0.244 . . . . 0.0 111.171 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -107.09 -43.73 4.55 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.485 ' CE1' HD13 ' A' ' 34' ' ' LEU . 45.3 m80 -98.24 132.6 43.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.703 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.426 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 5.8 tp-100 -93.03 -22.48 19.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.647 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.92 166.88 23.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 111.7 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.571 ' CE2' HG13 ' A' ' 110' ' ' ILE . 38.1 p90 -139.23 174.76 10.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.417 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 120' ' ' ARG . 0.1 OUTLIER -160.01 158.52 30.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.147 0.499 . . . . 0.0 111.624 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.443 ' CH2' HG21 ' A' ' 103' ' ' VAL . 85.8 m95 -123.0 106.96 11.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.62 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.451 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.34 165.27 26.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.83 -151.22 2.54 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.364 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.47 HD23 ' CD ' ' A' ' 141' ' ' GLN . 6.9 tp -76.55 -42.8 41.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.86 0.362 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -61.5 -52.49 64.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.83 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.672 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.92 -45.0 71.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.97 0.414 . . . . 0.0 110.615 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.16 66.36 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.266 0.555 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.52 -32.33 25.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.257 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.672 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -65.18 -44.49 88.32 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.525 ' HG ' ' NE2' ' A' ' 129' ' ' GLN . 1.2 mt -76.23 -44.81 35.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.753 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.09 55.34 1.79 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.814 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.75 -34.2 0.14 Allowed 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.415 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.459 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 14.1 m-85 -55.92 118.18 4.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.678 -179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -45.55 -50.91 12.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.52 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.543 ' CD ' HN62 ' A' ' 154' ' ' ATP . 31.0 mp0 -46.6 -54.69 8.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.776 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.756 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -64.21 -45.21 89.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.118 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.22 -41.7 50.33 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.501 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -70.64 -47.93 57.52 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.777 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.457 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.86 -42.75 62.88 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.138 0.494 . . . . 0.0 110.307 179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.47 -31.55 42.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.95 178.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -63.52 -51.19 66.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.596 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.54 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -70.97 -27.63 63.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.936 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -59.05 -49.35 79.4 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.256 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.447 ' CD2' HD12 ' A' ' 29' ' ' ILE . 2.6 t-160 -74.3 -29.12 61.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.922 0.391 . . . . 0.0 110.624 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -67.41 -52.32 41.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.177 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -62.05 -53.14 59.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.21 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.539 ' CD2' HG12 ' A' ' 78' ' ' ILE . 76.6 mt -54.67 -28.34 46.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.851 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -10.95 59.71 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.866 0.365 . . . . 0.0 110.808 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.46 -9.75 34.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.801 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.475 ' CD1' HD22 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -83.86 -135.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.936 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.7 -70.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.926 0.393 . . . . 0.0 110.733 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -175.56 -63.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.115 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.762 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.567 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.908 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.908 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.36 141.56 35.54 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.294 3.33 . . . . 0.0 109.646 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.32 166.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 110.831 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.71 94.23 0.12 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.844 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.9 p -148.66 16.23 0.99 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.758 0.313 . . . . 0.0 111.114 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -87.45 117.27 26.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 110.847 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 60.13 169.7 0.08 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.701 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.582 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.24 128.13 54.45 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.096 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.57 116.59 19.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.658 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.496 ' CB ' ' HD3' ' A' ' 94' ' ' LYS . . . -132.78 168.82 17.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.047 0.451 . . . . 0.0 111.619 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.7 m -156.31 123.99 5.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.261 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.93 176.71 17.75 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.76 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.508 HD22 HD13 ' A' ' 77' ' ' ILE . 1.2 mt -129.96 120.87 25.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 117.237 0.519 . . . . 0.0 112.322 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.503 ' CG1' ' HB3' ' A' ' 98' ' ' TYR . 5.7 mm -80.63 91.77 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.564 ' CG2' HG12 ' A' ' 103' ' ' VAL . 75.7 mt -84.88 136.7 22.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.574 -177.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.691 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 45.2 p90 -150.17 131.16 14.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.283 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.539 ' HG3' ' CA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.66 113.95 24.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 110.334 178.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.48 134.36 34.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.435 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.95 159.0 15.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.172 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.65 -83.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.421 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 2.8 pp -118.06 148.07 42.75 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.634 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 14.7 Cg_exo -68.77 161.27 46.15 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.835 2.357 . . . . 0.0 112.285 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.46 -63.44 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.659 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.455 ' O ' ' CB ' ' A' ' 25' ' ' ASP . 10.8 p -98.93 -23.76 4.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.198 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.455 ' CB ' ' O ' ' A' ' 24' ' ' VAL . 6.0 m-20 89.43 34.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.721 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -119.53 -78.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.344 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -93.43 156.32 16.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.039 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -167.51 -48.33 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.62 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.687 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.3 mt -109.63 144.14 18.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.477 0.656 . . . . 0.0 112.094 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.623 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.0 mm-40 -124.1 172.67 8.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.589 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.547 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 40.4 m-85 -133.46 133.94 42.91 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.688 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.522 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 29.8 tp -75.38 134.58 40.92 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 6.3 mt -135.06 135.43 41.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.082 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.456 HD12 ' HG3' ' A' ' 46' ' ' PRO . 38.9 mt -112.51 102.3 10.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.655 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 5.2 tm0? -61.62 134.35 56.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 111.735 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.0 131.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.821 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.562 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 27.0 t -84.64 9.75 12.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.672 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -157.17 -169.02 2.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.649 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.41 -121.55 10.09 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.658 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.565 HG12 ' ND1' ' A' ' 42' ' ' HIS . 23.0 pt -100.66 9.35 8.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 63.0 50.31 3.19 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -178.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.565 ' ND1' HG12 ' A' ' 40' ' ' ILE . 4.8 p-80 -101.2 150.55 22.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.841 -178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.655 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 32.9 m95 -92.84 139.68 30.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.147 0.499 . . . . 0.0 111.957 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.434 ' HB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -157.9 139.12 9.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.002 179.233 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.423 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.3 Cg_endo -66.85 175.51 5.35 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.232 1.955 . . . . 0.0 112.001 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.486 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 32.1 Cg_exo -59.4 113.01 1.42 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.762 2.308 . . . . 0.0 112.55 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.434 ' NZ ' ' HB ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -112.5 141.44 46.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.829 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.51 167.8 21.28 Favored Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.629 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 48.8 m-70 -113.86 101.89 9.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.811 0.339 . . . . 0.0 110.706 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.507 ' N ' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -67.77 129.98 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.567 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -90.61 172.11 7.37 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.724 -179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.5 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 73.3 Cg_exo -50.03 -63.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.57 2.18 . . . . 0.0 112.733 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.03 10.38 58.14 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.292 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.567 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 16.7 tt0 -89.22 161.51 16.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.044 0.422 . . . . 0.0 110.912 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.88 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 8.6 t0 -86.81 162.94 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.763 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.48 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -75.15 -63.23 1.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.842 0.353 . . . . 0.0 111.224 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HG ' HD11 ' A' ' 61' ' ' LEU . 26.8 tp -62.75 -40.89 98.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.88 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.36 -47.94 55.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.48 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.507 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.6 m -54.19 -42.61 69.92 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.472 ' HB3' ' HG ' ' A' ' 13' ' ' LEU . . . -70.16 -37.13 75.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.825 178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.538 HD21 ' CB ' ' A' ' 72' ' ' ALA . 96.2 mt -64.8 -52.7 55.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.593 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.467 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.4 tpt180 -62.87 -40.32 97.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.442 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.17 -32.22 73.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.06 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.513 HG22 ' CD1' ' A' ' 15' ' ' ILE . 63.5 m -65.1 -49.46 69.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.681 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.506 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -76.92 -22.88 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.877 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -79.29 -33.47 43.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.853 0.359 . . . . 0.0 111.228 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -106.74 -16.63 14.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.664 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.524 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -129.85 -6.81 4.51 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.473 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 75.25 -5.57 33.98 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.77 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.506 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.8 mt -98.97 124.22 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 CA-C-N 117.013 0.407 . . . . 0.0 110.529 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.457 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 9.6 pt-20 -110.31 170.65 7.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.106 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.555 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.44 -32.51 3.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.828 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.6 -25.75 74.51 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.088 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.457 ' HB3' HG23 ' A' ' 70' ' ' ILE . 11.2 mm-40 -94.41 1.47 55.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.409 0.147 . . . . 0.0 111.146 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 103' ' ' VAL . 0.0 OUTLIER -141.39 -173.92 3.89 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.924 0.392 . . . . 0.0 110.705 178.57 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.538 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 42.4 m -135.93 98.15 3.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.686 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.508 HD13 HD22 ' A' ' 13' ' ' LEU . 11.5 mm -68.69 107.72 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.453 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -70.58 133.09 32.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 121.274 0.559 . . . . 0.0 110.715 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -90.96 150.9 21.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.212 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.19 -25.67 22.83 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.092 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.514 ' CD1' HD23 ' A' ' 100' ' ' LEU . 21.7 t80 -102.43 119.96 39.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.8 0.333 . . . . 0.0 111.091 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.506 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -149.75 124.75 9.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.275 0.559 . . . . 0.0 110.86 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -148.79 138.14 21.76 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.669 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 2.7 pm0 -118.25 121.06 39.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.034 0.445 . . . . 0.0 111.047 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.618 HD12 ' HE2' ' A' ' 98' ' ' TYR . 5.5 mt -85.09 123.45 30.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.35 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.4 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.2 m-80 -115.45 120.29 39.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.642 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -167.33 141.18 3.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.818 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.485 ' CG2' ' N ' ' A' ' 92' ' ' LYS . 11.6 p -81.46 109.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.238 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.445 ' CB ' " H4'" ' A' ' 154' ' ' ATP . . . -78.53 -100.68 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.039 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -38.58 89.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 173.64 28.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.646 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.582 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -157.02 130.15 4.49 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.495 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.624 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 41.1 Cg_endo -65.46 120.12 7.26 Favored 'Trans proline' 0 CA--C 1.512 -0.594 0 C-N-CA 123.263 2.642 . . . . 0.0 112.368 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.553 ' HD3' HG21 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -103.74 127.24 51.23 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.859 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 84' ' ' GLU . 69.5 m -100.12 105.14 16.73 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.669 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 52.8 t -105.48 107.72 23.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.933 -178.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.606 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.76 111.47 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.618 ' HE2' HD12 ' A' ' 85' ' ' LEU . 7.4 m-85 -91.05 166.02 13.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.506 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -157.01 134.07 10.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.421 -179.552 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.514 HD23 ' CD1' ' A' ' 81' ' ' PHE . 1.3 mt -73.41 132.69 43.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.301 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.538 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -139.51 138.61 36.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.146 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.691 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.3 tt0 -108.85 109.52 20.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.895 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 105' ' ' ASP . 6.1 m -72.49 149.86 8.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.211 0.529 . . . . 0.0 111.39 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.15 -8.18 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.933 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.587 ' O ' HG22 ' A' ' 103' ' ' VAL . 3.2 t70 -149.47 117.88 6.49 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.165 0.507 . . . . 0.0 112.238 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.539 ' CA ' ' HG3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -49.68 -39.73 37.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.315 0.579 . . . . 0.0 110.365 178.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -101.54 25.0 8.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.877 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 105' ' ' ASP . 3.4 p -43.92 156.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.109 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.657 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 3.1 pm0 -60.94 139.7 57.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.274 0.559 . . . . 0.0 110.917 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.637 HG13 ' CE2' ' A' ' 119' ' ' TYR . 45.8 mm -122.14 99.52 7.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.429 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.473 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 2.4 mtt180 -102.7 96.61 6.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.317 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.499 HD23 ' CG2' ' A' ' 110' ' ' ILE . 5.6 mt -86.86 149.55 24.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.834 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.8 m -88.9 -170.14 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -71.49 -5.59 34.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.603 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.0 -24.3 18.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 110.965 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 14.8 m80 -106.52 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.642 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.562 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 13.4 pt20 -123.72 -20.76 5.38 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -161.87 171.85 17.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.158 0.504 . . . . 0.0 111.857 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.637 ' CE2' HG13 ' A' ' 110' ' ' ILE . 46.1 p90 -149.43 177.73 9.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.504 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.4 mtt180 -166.6 162.91 16.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.316 0.579 . . . . 0.0 111.949 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 80.4 m95 -125.17 106.8 10.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.224 178.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.447 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -134.85 170.46 15.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 0.0 111.819 -178.698 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -77.31 -152.95 5.41 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.827 179.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 141' ' ' GLN . 5.7 tp -77.72 -42.93 32.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.69 0.281 . . . . 0.0 111.59 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.519 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.7 pt-20 -60.69 -49.69 76.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.488 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.1 OUTLIER -69.58 -52.35 26.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.93 0.395 . . . . 0.0 110.006 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 123' ' ' GLY . . . -50.56 -28.12 8.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.382 0.611 . . . . 0.0 109.68 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.406 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 1.0 OUTLIER -83.05 -38.3 22.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.871 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.59 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -58.34 -47.73 82.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.995 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.545 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -77.16 -40.34 45.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.491 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -76.74 54.62 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.634 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.34 -35.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.822 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.509 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 6.5 m-85 -58.43 120.62 9.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -46.77 -48.38 20.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.514 ' C ' HD13 ' A' ' 85' ' ' LEU . 2.1 mp0 -51.17 -53.37 35.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.486 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.491 ' CB ' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -58.62 -39.52 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.057 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.583 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -56.99 -44.94 83.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.935 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -66.52 -46.55 75.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.493 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -52.52 -44.63 65.87 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.939 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -80.9 -26.65 36.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.222 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.583 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.77 -51.81 37.1 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.723 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -74.57 -31.61 62.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.597 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.52 -48.3 60.96 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.165 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.431 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 8.2 t-80 -74.95 -32.25 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.041 0.448 . . . . 0.0 110.579 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 31.9 tp60 -64.85 -52.41 56.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.512 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.418 ' CD1' HD13 ' A' ' 150' ' ' ILE . 32.8 t80 -58.03 -54.16 50.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.262 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.577 HD11 ' CE2' ' A' ' 16' ' ' PHE . 72.5 mt -58.0 -32.17 67.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.857 -179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -15.99 58.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.787 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -19.35 20.08 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.666 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.511 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 1.8 mt -79.21 -132.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -166.37 -64.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.747 0.308 . . . . 0.0 110.576 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -145.34 -68.95 0.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.797 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.509 ' C8 ' ' CZ ' ' A' ' 133' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.488 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -72.33 63.88 3.58 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 C-N-CA 124.336 3.357 . . . . 0.0 109.6 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.9 mp 58.2 -176.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -60.94 163.94 18.87 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.367 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.06 -176.07 0.24 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 110.643 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.2 tpt -55.87 178.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.065 179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.588 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 72.38 168.83 0.32 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.121 0.486 . . . . 0.0 110.735 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.689 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -102.71 132.91 48.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.643 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.599 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.65 122.64 28.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.319 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' A' ' 95' ' ' THR . . . -135.73 165.57 25.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.752 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 57.8 m -154.41 123.22 6.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.145 0.497 . . . . 0.0 111.236 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.41 172.41 14.27 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.535 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.479 HD23 ' HB2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -126.65 117.17 22.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.018 0.409 . . . . 0.0 111.249 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.654 HG13 ' HB3' ' A' ' 98' ' ' TYR . 76.1 mt -83.95 90.84 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.636 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 43.2 mt -80.71 145.45 8.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.77 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.684 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 47.6 p90 -149.84 122.14 8.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.302 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.781 ' HD3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -81.54 112.9 19.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.274 179.268 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -91.62 102.77 15.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.796 0.332 . . . . 0.0 111.419 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 93.1 m -85.02 159.19 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.353 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.5 tp -60.56 -81.08 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.868 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.3 pp -136.97 155.13 76.44 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.695 0.283 . . . . 0.0 111.333 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.1 157.19 30.68 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.482 2.121 . . . . 0.0 111.646 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -121.24 -77.5 0.59 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.496 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 t -134.57 -38.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.747 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -161.37 60.77 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.044 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -150.1 115.0 5.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.277 0.561 . . . . 0.0 110.947 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -53.15 162.05 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.515 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -59.15 2.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.783 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.684 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.4 mt -107.82 143.12 18.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.254 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.568 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 1.4 mt-10 -134.7 124.94 26.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.034 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.636 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.7 m-85 -89.66 144.6 25.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.609 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 43.1 tp -86.1 131.13 34.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.777 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.444 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.6 mt -129.69 140.16 51.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.618 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.506 HD13 ' HG3' ' A' ' 46' ' ' PRO . 10.7 mt -119.75 103.99 9.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.806 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -57.85 119.79 7.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.409 -179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.55 140.5 56.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.0 p -90.9 15.9 10.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.344 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -153.14 -167.57 2.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.728 0.299 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.55 -134.93 51.1 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.093 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.462 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -87.7 6.5 3.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 O-C-N 122.664 -0.315 . . . . 0.0 111.282 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 m-70 67.79 33.49 4.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.92 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.462 ' HB3' HD11 ' A' ' 40' ' ' ILE . 0.3 OUTLIER -69.97 172.38 7.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.605 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.58 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 48.9 m95 -108.13 110.19 21.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.844 0.355 . . . . 0.0 111.264 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.439 ' HB ' ' CD ' ' A' ' 47' ' ' LYS . 53.7 p -128.93 130.6 23.45 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.102 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.56 179.57 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.47 2.113 . . . . 0.0 112.102 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.629 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.6 Cg_exo -54.23 99.96 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.122 1.881 . . . . 0.0 112.093 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -99.34 140.83 32.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.862 0.363 . . . . 0.0 110.927 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.33 164.55 26.56 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.381 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -102.4 111.67 24.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.628 0.251 . . . . 0.0 110.582 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.599 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -86.45 134.34 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.447 0.641 . . . . 0.0 111.291 -179.681 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.737 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 9.0 tt0 -90.64 150.47 42.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.122 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.14 -23.37 22.22 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.761 2.307 . . . . 0.0 112.972 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.737 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.66 -11.24 38.58 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.509 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -84.66 166.51 17.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.875 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.4 t70 -80.35 159.0 25.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.214 0.531 . . . . 0.0 110.263 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.521 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.55 -66.39 0.63 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.734 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.55 HD13 ' CD2' ' A' ' 99' ' ' TRP . 30.9 tp -63.12 -38.06 89.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.437 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.875 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.84 -50.48 45.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.708 0.289 . . . . 0.0 110.498 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.468 HG22 ' CA ' ' A' ' 50' ' ' VAL . 53.9 m -54.62 -45.89 73.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 109.938 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.21 69.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.184 178.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.49 HD12 ' HG ' ' A' ' 57' ' ' LEU . 93.9 mt -74.6 -52.3 12.13 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.466 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -43.71 90.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.416 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.05 -32.83 72.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.388 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.629 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 87.5 m -61.55 -52.77 63.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.466 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.448 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.1 tt0 -75.06 -23.0 58.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.4 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -79.49 -40.05 30.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.877 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HE2' ' CB ' ' A' ' 115' ' ' GLU . 5.5 mm-40 -104.16 1.41 30.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.095 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.527 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -147.13 -12.44 0.42 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.545 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 78.87 -7.91 47.41 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.779 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.471 ' CG2' ' CD2' ' A' ' 75' ' ' LEU . 2.8 mt -96.32 122.49 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.529 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.461 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 6.0 pt-20 -104.48 167.42 9.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.559 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -47.23 -35.76 8.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.526 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.08 -23.77 76.04 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.018 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.46 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 3.6 tp60 -94.96 -5.65 44.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.793 0.33 . . . . 0.0 111.198 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.559 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.51 -170.99 2.54 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.443 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.458 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 35.7 m -137.75 100.86 4.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.524 HD13 ' HB2' ' A' ' 101' ' ' ALA . 13.3 mm -73.15 109.76 5.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.188 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.466 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -71.63 136.22 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.962 0.411 . . . . 0.0 110.427 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -93.72 149.74 20.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.511 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.0 -15.96 54.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.528 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.445 ' CZ ' HD21 ' A' ' 100' ' ' LEU . 18.9 t80 -104.78 135.62 45.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.76 0.315 . . . . 0.0 111.24 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.598 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.99 138.1 12.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.126 0.488 . . . . 0.0 111.437 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 142.78 5.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.347 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.692 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 2.5 pm0 -132.51 127.34 34.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.903 0.382 . . . . 0.0 111.176 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.623 HD11 ' HE2' ' A' ' 98' ' ' TYR . 8.3 mt -90.55 117.31 29.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.433 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -113.96 126.56 55.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.774 -178.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.616 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 22.3 p90 -167.71 141.58 3.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.01 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.668 ' O ' HG11 ' A' ' 88' ' ' VAL . 10.6 p -84.97 111.88 21.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.136 0.493 . . . . 0.0 110.246 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.427 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -71.26 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.442 -178.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -80.0 -37.69 33.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.825 0.345 . . . . 0.0 110.704 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.67 26.99 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.169 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.689 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.62 122.09 2.66 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-O 120.899 0.381 . . . . 0.0 110.896 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.588 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 58.0 Cg_endo -71.68 118.21 5.53 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.223 2.615 . . . . 0.0 112.945 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.672 ' HD3' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -96.76 124.37 40.72 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.069 -179.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.7 m -94.14 110.25 21.98 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.692 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.5 t -109.89 107.57 23.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.386 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.621 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.62 128.74 39.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.654 ' HB3' HG13 ' A' ' 14' ' ' ILE . 26.2 m-85 -114.07 136.39 52.97 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.598 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.5 m-90 -123.37 146.07 48.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.128 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.465 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 3.1 mt -78.63 125.97 30.1 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -132.67 147.71 52.34 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.687 0.28 . . . . 0.0 111.388 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.463 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 7.5 tt0 -126.37 111.95 15.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.748 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.547 ' HA ' ' HA ' ' A' ' 75' ' ' LEU . 6.2 m -72.08 130.16 35.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.294 0.569 . . . . 0.0 110.81 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.55 -23.88 67.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.395 -177.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.672 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 5.7 t70 -107.13 130.23 54.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.074 0.464 . . . . 0.0 112.205 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.781 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 11.2 t80 -66.67 -37.08 84.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.931 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.61 26.4 10.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.064 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.672 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.8 p -43.8 146.86 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.925 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -71.3 142.55 50.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.344 0.592 . . . . 0.0 111.252 -179.166 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.588 HG13 ' CE2' ' A' ' 119' ' ' TYR . 43.0 mm -119.64 98.72 6.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.365 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.545 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 1.3 mtp85 -95.7 102.77 14.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.217 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.487 HD23 ' CG2' ' A' ' 110' ' ' ILE . 11.6 mt -100.24 139.85 35.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.804 179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.9 p -94.89 -154.94 0.44 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.601 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 19.12 1.06 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.521 0.201 . . . . 0.0 111.249 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.428 ' CB ' ' HE2' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -103.85 -35.25 8.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.776 179.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.431 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 81.0 m-70 -117.74 139.78 50.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.968 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -92.92 -16.18 25.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.247 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.42 177.35 3.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 111.332 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.588 ' CE2' HG13 ' A' ' 110' ' ' ILE . 49.5 p90 -148.2 169.71 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.756 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.44 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -159.18 153.48 23.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.159 0.504 . . . . 0.0 111.746 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.466 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -114.49 107.08 15.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.507 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.423 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.24 167.55 21.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.489 -178.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -152.56 3.73 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.636 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.2 tp -76.96 -45.47 27.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.929 0.365 . . . . 0.0 110.967 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.6 pt-20 -56.99 -51.34 69.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.489 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.766 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.74 -46.74 62.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.938 0.399 . . . . 0.0 110.539 -179.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.444 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -55.66 -30.62 61.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.262 0.553 . . . . 0.0 109.635 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 3.1 m -84.26 -29.7 26.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.433 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.766 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.18 -42.67 88.56 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.979 0.419 . . . . 0.0 110.719 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.616 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -77.57 -45.1 26.34 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.762 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.542 ' CB ' ' HB3' ' A' ' 136' ' ' MET . . . -79.6 56.68 2.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.502 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -34.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.152 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.548 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 10.0 m-85 -58.82 123.85 17.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.81 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.53 -54.67 7.21 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.859 ' HG2' HN61 ' A' ' 154' ' ' ATP . 0.0 OUTLIER -44.77 -57.88 3.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.918 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.542 ' HB3' ' CB ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.26 -36.5 75.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.009 0.433 . . . . 0.0 110.575 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -62.7 -37.88 88.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.923 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.55 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.84 -45.6 67.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.578 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.514 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -52.23 -44.92 65.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.246 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.25 -29.64 48.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.016 178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.55 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -62.28 -51.67 66.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.165 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -70.49 -30.03 66.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.716 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.7 -51.65 43.11 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -77.34 -29.2 53.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.86 0.362 . . . . 0.0 110.659 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.23 -52.51 54.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.008 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.451 ' CD1' HD11 ' A' ' 150' ' ' ILE . 55.3 t80 -60.6 -54.75 41.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.8 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.549 HD12 ' CZ ' ' A' ' 16' ' ' PHE . 90.0 mt -54.73 -36.84 65.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.619 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 19.3 t -66.14 -13.16 59.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.063 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.97 -18.64 18.51 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.37 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.532 ' CD1' HD21 ' A' ' 147' ' ' LEU . 1.5 mt -77.66 -130.15 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.516 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -168.95 -57.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.056 0.455 . . . . 0.0 110.435 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -151.89 -34.87 0.13 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.156 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.906 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.859 HN61 ' HG2' ' A' ' 135' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.83 ' O ' HD22 ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.551 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.77 ' HG3' ' CD2' ' A' ' 49' ' ' HIS . 81.6 Cg_endo -72.42 55.03 2.47 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 124.306 3.337 . . . . 0.0 109.594 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.83 HD22 ' O ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -76.13 121.4 22.78 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.066 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 168.18 143.03 3.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.703 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 m 62.6 -177.5 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.863 0.363 . . . . 0.0 111.309 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.66 131.64 41.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.669 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.66 168.88 0.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.26 0.552 . . . . 0.0 111.072 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.569 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -107.65 139.88 41.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.563 179.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' HB3' HG11 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.37 118.18 23.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.982 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' CB ' ' HG2' ' A' ' 94' ' ' LYS . . . -129.81 165.67 21.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.977 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 11.2 m -157.79 123.94 4.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.203 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.585 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.2 172.91 14.62 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.182 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.478 ' HG ' ' HB1' ' A' ' 60' ' ' ALA . 2.1 mt -125.83 117.74 24.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.764 0.316 . . . . 0.0 111.386 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.645 HG13 ' HB3' ' A' ' 98' ' ' TYR . 51.9 mt -85.3 91.0 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.614 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 64.6 mt -79.13 139.86 17.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.096 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.605 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.4 p90 -144.13 121.16 11.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.41 -178.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.84 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -87.34 118.59 26.88 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.69 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.6 ttm-85 -92.3 113.39 25.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.458 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.4 160.15 29.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.4 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.423 HD13 HG13 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -60.03 -95.64 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.423 HG13 HD13 ' A' ' 20' ' ' LEU . 2.1 pp -107.72 153.64 41.37 Favored Pre-proline 0 C--N 1.332 -0.159 0 CA-C-O 120.712 0.291 . . . . 0.0 111.079 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -66.73 154.16 75.46 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.607 2.205 . . . . 0.0 112.155 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 -82.71 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.2 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 13.4 t -86.92 -7.03 10.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.1 t70 64.24 47.51 3.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.887 0.375 . . . . 0.0 110.423 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -105.53 -55.19 2.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.281 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -159.09 95.79 1.29 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.581 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.1 76.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.559 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.605 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.5 mt -110.89 143.17 21.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.219 0.533 . . . . 0.0 111.791 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 11.7 mp0 -131.25 138.01 49.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.712 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.614 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.0 m-85 -101.38 152.23 20.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.047 0.451 . . . . 0.0 112.047 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.519 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 45.7 tp -86.72 138.51 31.57 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.96 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.3 mt -137.72 139.69 40.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.889 0.376 . . . . 0.0 111.006 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HB2' ' CE1' ' A' ' 116' ' ' HIS . 10.4 mt -119.2 109.3 15.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.127 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.561 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.0 tt0 -64.78 140.78 58.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.075 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.11 139.16 58.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.169 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 p -78.71 10.55 3.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.442 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.09 -162.65 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.744 0.307 . . . . 0.0 110.404 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.51 -120.3 9.02 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.753 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.47 ' CD1' ' HB3' ' A' ' 42' ' ' HIS . 5.2 pt -101.36 8.81 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 61.38 41.35 13.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.388 0.613 . . . . 0.0 109.521 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.478 ' H ' ' ND1' ' A' ' 42' ' ' HIS . 9.0 p-80 -88.71 149.82 23.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.101 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.561 ' CZ3' ' HB2' ' A' ' 35' ' ' GLN . 40.1 m95 -98.63 145.1 27.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.663 -179.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -161.62 149.61 12.33 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.656 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.503 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 38.4 Cg_endo -65.01 166.69 17.86 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.535 2.157 . . . . 0.0 111.974 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.487 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 18.1 Cg_exo -66.51 87.88 0.27 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.64 2.227 . . . . 0.0 112.519 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.585 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.6 pttt -98.81 145.32 27.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.42 -166.04 12.02 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.879 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.77 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -119.51 102.49 8.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.624 0.25 . . . . 0.0 111.021 -179.664 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.536 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.4 p -76.74 122.05 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.898 0.38 . . . . 0.0 110.752 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.491 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -78.12 172.81 8.85 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.768 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 52.6 Cg_exo -54.62 -56.47 2.43 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.387 2.058 . . . . 0.0 112.305 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.08 14.3 61.01 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.974 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.491 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 71.0 tt0 -94.22 158.96 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.863 0.332 . . . . 0.0 110.661 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.921 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.0 t70 -79.37 159.47 27.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.65 -58.87 3.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.347 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.453 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 37.1 tp -65.74 -39.79 91.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.84 0.352 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.921 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.45 -49.98 53.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.442 179.717 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.536 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 85.9 m -54.34 -42.79 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.478 ' HB1' ' HG ' ' A' ' 13' ' ' LEU . . . -70.97 -30.56 66.86 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.098 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 89.5 mt -71.16 -52.68 17.87 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.69 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.423 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 ttp85 -60.73 -41.32 95.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.478 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.09 -31.83 72.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.116 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.487 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 85.5 m -64.9 -49.9 68.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.432 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.46 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -77.43 -26.27 51.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.74 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -79.34 -35.9 40.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.822 0.344 . . . . 0.0 111.023 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.434 ' O ' HD23 ' A' ' 112' ' ' LEU . 2.3 mp0 -106.75 0.92 24.53 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.733 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.59 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -148.3 -7.12 0.41 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.567 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 73.64 -4.87 26.01 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.056 -1.069 . . . . 0.0 113.121 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.489 HG21 HG13 ' A' ' 103' ' ' VAL . 1.5 mt -100.09 126.75 53.52 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.08 0 CA-C-N 117.214 0.507 . . . . 0.0 110.503 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.502 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.0 pt-20 -109.02 169.55 8.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.424 . . . . 0.0 111.722 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.547 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -47.86 -35.55 10.54 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.818 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.19 -22.06 78.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.131 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.442 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.6 tp60 -97.31 0.85 48.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.494 0.187 . . . . 0.0 111.397 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.547 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.28 -176.51 4.74 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.117 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.583 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 65.5 m -132.45 100.48 4.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 111.463 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.421 HD12 HD22 ' A' ' 13' ' ' LEU . 9.7 mm -70.17 119.06 15.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.803 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.498 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.59 134.38 27.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.148 0.499 . . . . 0.0 111.113 -179.602 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -93.79 150.97 19.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.312 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.13 -22.96 37.82 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.332 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.48 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 19.0 t80 -105.75 126.04 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.579 0.228 . . . . 0.0 110.847 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.495 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 2.2 ttpt -157.55 126.74 5.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.159 0.504 . . . . 0.0 111.615 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.492 HH21 ' HE2' ' A' ' 84' ' ' GLU . 0.1 OUTLIER -149.09 139.43 22.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.845 179.349 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.643 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -122.29 137.81 54.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.111 0.481 . . . . 0.0 111.55 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.459 ' CD1' ' HB3' ' A' ' 135' ' ' GLU . 4.0 mt -103.75 120.7 41.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.583 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -110.95 127.7 55.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.778 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.577 ' CG ' ' C6 ' ' A' ' 154' ' ' ATP . 26.5 p90 -166.95 141.72 4.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.929 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.644 ' O ' HG11 ' A' ' 88' ' ' VAL . 9.0 p -85.35 112.87 22.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.836 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.414 ' CB ' H5'2 ' A' ' 154' ' ' ATP . . . -77.16 -95.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.525 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.81 -37.32 64.92 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-O 120.841 0.353 . . . . 0.0 110.712 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.434 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.0 t-20 178.21 26.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.105 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.569 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.01 124.4 3.4 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.049 179.716 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.604 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 67.6 Cg_endo -74.2 118.91 5.57 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 123.145 2.563 . . . . 0.0 112.376 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.408 ' HA ' HD13 ' A' ' 8' ' ' LEU . 4.4 ttpt -103.59 126.36 50.68 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.616 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.9 m -87.62 107.29 18.54 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 18.4 t -105.52 108.31 24.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.026 -178.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.626 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -86.24 129.51 38.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.8 m-85 -113.63 131.98 55.93 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.495 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.3 m-90 -119.58 140.69 50.16 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.774 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.468 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -77.67 133.11 38.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.645 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.583 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -142.03 140.93 32.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.795 0.331 . . . . 0.0 111.541 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.553 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 8.4 tt0 -113.15 111.6 22.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 75' ' ' LEU . 7.0 m -71.61 151.06 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.339 0.59 . . . . 0.0 111.65 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.488 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -75.7 -7.6 54.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.927 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.545 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 9.7 t70 -143.89 115.1 7.95 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-O 121.154 0.502 . . . . 0.0 112.349 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.84 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 0.4 OUTLIER -49.35 -40.21 34.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.694 178.885 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -102.95 24.72 10.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.793 178.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.545 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.3 p -43.52 151.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.667 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 2.6 pm0 -61.24 138.78 58.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.346 0.593 . . . . 0.0 110.193 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.612 ' CG2' HD22 ' A' ' 112' ' ' LEU . 33.6 mm -121.87 98.07 5.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.295 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.567 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 21.6 mtp180 -97.1 105.64 17.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.196 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.612 HD22 ' CG2' ' A' ' 110' ' ' ILE . 13.7 mt -92.21 155.49 17.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 111.371 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.07 -168.06 1.54 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.641 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -67.1 -18.5 65.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.442 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -84.3 -14.24 50.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.652 0.263 . . . . 0.0 111.521 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 92.7 m-70 -117.99 164.26 15.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.967 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -138.56 -28.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.715 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.8 158.6 37.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.93 0.395 . . . . 0.0 111.619 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.534 ' CE2' HG13 ' A' ' 110' ' ' ILE . 44.4 p90 -135.81 173.51 11.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.446 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.481 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 13.6 mtt85 -156.64 156.42 33.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.304 0.573 . . . . 0.0 111.671 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -120.49 107.17 12.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.659 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.485 HD22 HD12 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.59 170.51 15.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.998 0.428 . . . . 0.0 111.714 -178.413 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.39 -159.8 20.96 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.147 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.493 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.4 tp -69.61 -41.32 75.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.709 0.29 . . . . 0.0 111.475 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -62.87 -51.06 68.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.587 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.42 -51.2 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.838 0.351 . . . . 0.0 110.494 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -51.1 -31.1 18.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.261 0.553 . . . . 0.0 109.638 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 7.0 m -83.39 -29.11 28.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.295 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.549 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -66.91 -45.18 78.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.549 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -75.23 -43.46 51.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.69 51.67 1.11 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.911 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.42 -33.57 0.1 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.527 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.463 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.6 m-85 -55.79 118.54 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.329 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.72 -50.84 13.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.463 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 17.3 mp0 -46.94 -51.02 17.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.021 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.45 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -67.4 -39.96 85.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.72 0.295 . . . . 0.0 111.139 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -54.64 -33.98 61.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.092 179.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.492 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.52 -45.41 21.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.652 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.567 ' HB3' HD12 ' A' ' 14' ' ' ILE . . . -51.98 -48.15 64.51 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.395 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.25 -26.65 59.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.245 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.43 -51.93 38.34 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.967 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.48 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 5.1 mp0 -69.27 -28.97 66.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.251 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.523 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.83 -43.29 99.41 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.719 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -75.91 -27.75 57.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -70.94 -52.47 19.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.355 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.447 ' CE2' HD11 ' A' ' 150' ' ' ILE . 74.0 t80 -58.71 -53.83 53.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 -179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.715 HD21 HD13 ' A' ' 150' ' ' ILE . 83.4 mt -54.77 -29.4 53.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.594 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -13.42 62.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.729 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.37 -14.79 23.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.715 HD13 HD21 ' A' ' 147' ' ' LEU . 1.0 OUTLIER -85.26 -134.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -149.48 -59.03 0.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.898 0.38 . . . . 0.0 110.506 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 56.99 165.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.19 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.907 179.998 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.577 ' C6 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -72.37 156.3 54.78 Favored 'Trans proline' 0 N--CA 1.447 -1.223 0 C-N-CA 124.307 3.338 . . . . 0.0 109.557 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.46 152.33 21.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.818 0.342 . . . . 0.0 110.94 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.85 39.5 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.518 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 m -153.57 32.17 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.644 0.259 . . . . 0.0 110.998 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 ptm -75.23 164.29 26.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.91 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.657 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 60.19 162.39 0.05 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.653 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -114.14 141.67 47.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.732 -179.765 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.434 ' C ' HG12 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -80.66 126.56 31.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.773 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.677 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -137.72 161.62 36.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 m -156.44 123.08 5.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.17 0.51 . . . . 0.0 111.288 179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.69 176.99 17.24 Favored Glycine 0 N--CA 1.446 -0.633 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.201 178.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 13' ' ' LEU . 0.7 OUTLIER -130.71 117.64 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.139 0.47 . . . . 0.0 111.177 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.687 HD13 ' HB2' ' A' ' 139' ' ' ALA . 39.5 mt -84.13 90.3 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.647 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.605 ' CG2' HG11 ' A' ' 103' ' ' VAL . 83.2 mt -79.93 145.36 9.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.413 -178.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.633 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 47.9 p90 -152.6 127.72 9.76 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.124 -178.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.511 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -96.76 113.69 25.27 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.692 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' CZ ' ' HB2' ' A' ' 152' ' ' ALA . 0.6 OUTLIER -87.04 127.22 35.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.483 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.67 161.2 22.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.452 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -80.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.435 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.5 pp -119.69 150.38 50.16 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.77 0.319 . . . . 0.0 111.523 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.56 156.28 53.3 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.795 2.33 . . . . 0.0 112.224 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.62 -69.57 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.97 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.8 m -84.72 -12.83 11.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.393 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 63.11 29.81 16.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.921 0.391 . . . . 0.0 110.672 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -91.27 -71.02 0.65 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.875 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -143.46 102.08 3.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.657 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.09 84.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.408 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.577 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.0 mt -106.15 150.85 8.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.42 0.628 . . . . 0.0 111.713 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 37.4 mm-40 -120.72 173.5 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.033 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.514 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 21.9 m-85 -141.37 128.75 21.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.598 0.237 . . . . 0.0 111.218 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.547 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 39.6 tp -73.0 140.45 47.34 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.52 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.0 mt -139.91 145.32 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.972 0.415 . . . . 0.0 111.074 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.441 HD13 ' N ' ' A' ' 46' ' ' PRO . 7.9 mt -123.77 112.22 17.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.238 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.456 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt0 -72.09 147.78 46.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.204 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -51.49 177.54 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.386 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 p -106.45 -18.1 14.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.213 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -170.14 -19.43 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.21 -129.07 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.8 -0.714 . . . . 0.0 113.081 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.548 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.2 tt -80.4 2.52 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.302 . . . . 0.0 111.35 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 62.71 30.46 16.84 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.046 0.45 . . . . 0.0 110.27 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -69.06 151.33 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.315 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.583 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.4 m95 -109.63 117.83 34.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.194 0.521 . . . . 0.0 111.499 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 70.7 p -140.86 145.3 39.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.195 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -57.7 170.71 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.995 1.797 . . . . 0.0 111.452 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.548 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 53.6 Cg_exo -52.03 95.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.328 2.019 . . . . 0.0 112.541 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER -88.55 130.08 35.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.727 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.78 123.72 2.11 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.612 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.677 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 7.0 p80 -67.31 120.21 13.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.509 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.508 ' HB ' ' CB ' ' A' ' 59' ' ' THR . 1.5 p -83.32 140.09 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.122 0.487 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.708 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 5.6 tt0 -91.76 149.49 39.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.93 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.7 Cg_endo -55.27 -20.82 26.39 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.958 2.438 . . . . 0.0 113.355 -178.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.59 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.56 -11.68 43.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.619 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -90.56 168.56 11.72 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.027 0.442 . . . . 0.0 110.911 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.8 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.1 t70 -81.76 160.79 23.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.46 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -69.21 -66.93 0.52 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.578 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.515 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 29.1 tp -62.21 -38.04 87.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.166 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.8 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -51.08 -46.82 61.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.721 -179.705 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.508 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 95.9 m -55.83 -46.46 78.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -65.4 -31.77 73.04 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.981 178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 95.1 mt -72.14 -52.32 17.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.464 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.474 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 12.2 ttt-85 -62.41 -36.85 83.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.841 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 59' ' ' THR . . . -65.06 -31.65 72.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.548 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 24.4 m -62.51 -52.31 63.99 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.526 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.528 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -74.43 -24.38 59.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.739 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.6 -36.67 37.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.816 0.341 . . . . 0.0 110.597 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.69 10.58 22.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.683 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.572 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -158.53 -4.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.572 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 67.41 2.13 18.77 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.342 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.528 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.5 mt -104.28 125.75 59.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 117.085 0.442 . . . . 0.0 110.363 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -107.94 170.44 7.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.282 -179.435 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.526 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -48.69 -31.63 7.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.212 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.38 -26.41 74.21 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.889 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.534 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 1.2 mm-40 -96.25 2.17 52.7 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.526 ' CD1' ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -140.79 -179.15 5.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.047 0.451 . . . . 0.0 110.465 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.498 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.1 m -131.59 100.1 5.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.124 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.461 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 11.1 mm -71.1 112.29 5.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.022 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.456 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -74.18 134.07 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.026 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -93.16 150.93 20.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.74 39.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.16 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.422 ' CE1' HD22 ' A' ' 100' ' ' LEU . 21.1 t80 -104.41 123.49 47.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 110.607 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.47 128.69 6.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.276 0.56 . . . . 0.0 111.663 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.435 ' HE ' ' HA ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -158.38 142.71 15.87 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.415 179.255 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.684 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.5 OUTLIER -120.07 133.18 55.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.073 0.464 . . . . 0.0 111.93 -179.343 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.419 HD21 ' HD3' ' A' ' 83' ' ' ARG . 13.5 mt -97.53 116.19 29.27 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.731 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.605 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.2 p30 -115.53 133.34 56.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 111.506 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.615 ' CG ' ' C5 ' ' A' ' 154' ' ' ATP . 7.2 p90 -166.74 140.07 3.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.64 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.542 HG12 ' O ' ' A' ' 88' ' ' VAL . 8.9 p -81.26 107.19 13.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.338 0.59 . . . . 0.0 110.361 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.32 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.777 -178.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.4 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -77.01 -35.0 57.37 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.309 . . . . 0.0 110.992 -179.748 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.4 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 1.2 m-80 171.84 29.19 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.684 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.653 ' HB3' HD13 ' A' ' 8' ' ' LEU . 7.1 tptt -158.84 123.63 2.23 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.269 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.657 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 33.3 Cg_endo -67.9 121.1 8.1 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.988 2.459 . . . . 0.0 113.245 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.605 ' O ' ' HA ' ' A' ' 86' ' ' ASN . 0.0 OUTLIER -94.87 113.62 25.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.806 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.3 m -87.76 105.5 17.43 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.684 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 39.5 t -108.03 108.38 25.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.13 122.54 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.579 ' HB3' HG13 ' A' ' 14' ' ' ILE . 40.4 m-85 -102.92 147.16 27.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -177.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.475 ' CD2' HD12 ' A' ' 57' ' ' LEU . 1.1 m-90 -135.07 138.39 43.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.347 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.469 HD11 ' HG ' ' A' ' 147' ' ' LEU . 0.7 OUTLIER -74.55 135.43 42.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.517 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -139.75 139.11 36.4 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 120.777 0.322 . . . . 0.0 111.796 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.633 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 13.3 tt0 -113.09 107.94 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.256 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.605 HG11 ' CG2' ' A' ' 15' ' ' ILE . 9.0 m -72.1 139.76 19.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 121.329 0.585 . . . . 0.0 111.574 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.534 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 2.7 mptp? -69.25 -18.22 63.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.511 -178.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.645 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 18.8 t0 -124.25 127.77 48.18 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.511 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 t80 -60.65 -45.09 95.44 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.984 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -98.02 23.9 7.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.074 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.645 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.1 p -42.26 143.75 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.136 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -61.05 142.09 56.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.303 0.573 . . . . 0.0 111.144 -178.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.572 ' HA ' ' O ' ' A' ' 68' ' ' ALA . 28.7 mm -124.55 96.46 3.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.093 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.572 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 1.4 mtt180 -98.88 102.53 14.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.666 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.502 HD23 ' CG2' ' A' ' 110' ' ' ILE . 11.0 mt -88.61 -178.59 5.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.6 m -127.45 -168.13 1.84 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.275 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.43 -13.42 62.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.578 0.214 . . . . 0.0 111.578 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.84 -18.88 29.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.35 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.424 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 98.5 m-70 -131.04 123.36 28.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.483 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.95 0.5 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.115 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.16 160.2 6.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.937 0.399 . . . . 0.0 111.612 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.519 ' CE2' HG13 ' A' ' 110' ' ' ILE . 38.7 p90 -142.03 174.36 10.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.744 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.416 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 15.4 mtt180 -159.46 159.69 33.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.262 0.553 . . . . 0.0 111.784 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -121.45 107.26 12.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.787 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.423 ' O ' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -141.09 168.33 20.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 111.829 -178.639 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.48 -151.77 4.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.908 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 15.5 tp -76.91 -49.06 16.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.778 0.323 . . . . 0.0 111.151 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -52.53 -52.09 56.43 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.614 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.785 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -69.57 -51.25 37.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.079 0.466 . . . . 0.0 110.436 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.52 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.93 -29.28 19.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.032 178.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.7 m -84.36 -33.86 23.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.49 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.785 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.67 -42.9 95.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.954 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.618 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -78.15 -44.69 25.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.185 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.454 ' O ' ' HD2' ' A' ' 137' ' ' LYS . . . -76.78 55.69 1.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.097 0.475 . . . . 0.0 109.934 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.445 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.19 -32.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.379 -179.215 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.519 ' CZ ' " O2'" ' A' ' 154' ' ' ATP . 45.8 m-85 -57.98 119.21 6.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.538 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.06 -46.75 33.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.735 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.699 ' CD ' HN61 ' A' ' 154' ' ' ATP . 0.1 OUTLIER -51.18 -51.25 55.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.891 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -41.34 98.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 110.188 -179.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.454 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -55.9 -35.28 66.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.75 178.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.487 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.05 -44.65 25.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.171 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.687 ' HB2' HD13 ' A' ' 14' ' ' ILE . . . -52.83 -53.28 50.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.363 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.91 -27.17 64.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.086 179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.487 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.22 -51.95 64.19 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.016 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.64 -27.0 60.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.518 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -53.92 -47.1 67.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.203 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -78.81 -34.04 45.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.001 0.429 . . . . 0.0 110.611 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -62.31 -52.3 64.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.247 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.494 ' CD1' HD12 ' A' ' 150' ' ' ILE . 28.7 t80 -60.66 -52.61 64.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.133 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 93.1 mt -55.85 -31.88 63.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.483 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.66 -14.63 60.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.615 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.75 -12.24 27.53 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.515 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.494 HD12 ' CD1' ' A' ' 146' ' ' PHE . 1.1 mt -82.85 -131.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.93 -64.59 1.26 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.131 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.408 ' HB2' ' CZ ' ' A' ' 18' ' ' ARG . . . 64.01 114.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.126 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.81 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.699 HN61 ' CD ' ' A' ' 135' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.924 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.924 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 83.1 Cg_endo -72.32 88.31 0.86 Allowed 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 124.315 3.343 . . . . 0.0 109.614 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mt 59.68 87.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.024 0.44 . . . . 0.0 110.774 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.49 33.96 0.68 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.405 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.41 106.37 2.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.887 0.375 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.2 tmm? -89.22 127.54 35.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.986 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.635 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 68.42 170.37 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 111.704 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.646 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -105.53 134.24 48.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.367 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ttm-85 -80.31 118.24 21.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.724 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.52 ' HB2' ' HG3' ' A' ' 94' ' ' LYS . . . -134.65 166.88 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.659 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.7 m -157.04 123.78 5.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.053 0.454 . . . . 0.0 111.103 179.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.524 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -114.05 176.44 17.08 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.857 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.463 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -131.01 117.72 19.58 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.655 HG13 ' HB3' ' A' ' 98' ' ' TYR . 70.2 mt -82.92 90.88 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.635 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 20.1 mt -80.9 145.44 8.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.265 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.659 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.1 p90 -154.32 122.65 6.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.826 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.493 ' HG2' HG23 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -75.28 115.67 15.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.948 0.404 . . . . 0.0 110.729 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 -106.68 118.05 35.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.236 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.3 160.04 31.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.373 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tp -55.7 -80.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.658 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 1.8 pp -115.34 145.42 34.28 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.82 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 2.7 Cg_exo -75.68 157.67 39.83 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.768 2.312 . . . . 0.0 112.683 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -71.95 0.72 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.431 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.517 ' O ' HG13 ' A' ' 24' ' ' VAL . 11.1 t -104.89 5.71 10.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.862 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 t0 67.99 21.85 8.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.006 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.42 ' OD1' ' N ' ' A' ' 26' ' ' ASN . 2.4 p-10 -93.62 -83.56 0.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.868 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -94.92 124.19 38.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.36 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.98 -46.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.31 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.659 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.1 mt -108.26 138.36 35.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.046 0.451 . . . . 0.0 111.873 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 60.0 mt-10 -134.19 119.44 18.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.973 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.9 m-85 -82.66 149.19 27.51 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.579 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 38.9 tp -88.45 135.49 33.45 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.719 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.474 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.3 mt -135.82 141.54 44.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.808 0.337 . . . . 0.0 110.701 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB3' ' CG ' ' A' ' 116' ' ' HIS . 19.4 mt -119.64 112.77 19.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.97 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.471 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.5 tt0 -74.35 138.49 43.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.197 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.88 145.67 55.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.139 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.465 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 96.4 p -75.26 1.64 13.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.598 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -170.72 -161.14 0.22 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.665 0.269 . . . . 0.0 111.083 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.01 -128.54 40.06 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.779 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.469 HG21 ' HB3' ' A' ' 42' ' ' HIS . 11.2 tt -85.53 -6.93 10.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.764 0.316 . . . . 0.0 111.239 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 65.67 33.6 8.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.868 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.469 ' HB3' HG21 ' A' ' 40' ' ' ILE . 8.0 p-80 -66.27 149.14 50.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.924 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.59 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.9 m95 -106.03 119.48 39.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.49 141.79 19.77 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.133 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.63 158.44 8.11 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.719 2.28 . . . . 0.0 112.405 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.489 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 44.1 Cg_endo -66.62 101.28 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.723 2.282 . . . . 0.0 112.199 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.52 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.14 153.04 19.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.054 0.454 . . . . 0.0 111.561 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.13 164.19 22.23 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.273 179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.457 ' CE1' ' HB3' ' A' ' 8' ' ' LEU . 1.1 t-80 -96.54 102.85 14.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.645 0.26 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.595 ' N ' HG23 ' A' ' 59' ' ' THR . 1.3 p -71.26 130.72 35.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.08 0.466 . . . . 0.0 111.149 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.518 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -89.92 174.69 4.48 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.748 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.518 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 51.3 Cg_exo -56.0 -60.52 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.292 1.995 . . . . 0.0 112.462 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.92 7.28 63.35 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.928 -0.653 . . . . 0.0 113.471 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 41.6 tt0 -88.9 164.88 14.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 110.809 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.841 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -88.39 159.81 17.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.152 0.501 . . . . 0.0 110.631 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.407 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.66 -62.77 1.29 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.87 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.628 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 29.7 tp -64.43 -40.8 96.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.481 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.03 -46.4 52.92 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 120.589 0.233 . . . . 0.0 110.393 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.595 HG23 ' N ' ' A' ' 50' ' ' VAL . 44.6 m -55.89 -46.73 78.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -66.79 -27.92 67.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.465 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.3 mt -77.06 -52.13 9.86 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.686 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.62 -36.37 80.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.051 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 59' ' ' THR . . . -67.36 -33.76 75.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.202 0.525 . . . . 0.0 109.649 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.489 ' HA ' ' CG ' ' A' ' 46' ' ' PRO . 98.6 m -61.22 -55.79 28.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.573 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -68.21 -20.67 64.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.883 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -79.21 -45.58 19.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.908 0.385 . . . . 0.0 110.876 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 3.2 mp0 -104.96 9.87 34.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.628 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.512 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -149.75 -9.36 0.3 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.406 ' HA2' ' O ' ' A' ' 65' ' ' GLN . . . 69.93 0.94 29.76 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.01 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.573 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -106.3 130.81 57.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 117.087 0.444 . . . . 0.0 110.913 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -113.24 172.85 6.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.507 ' HB1' HD21 ' A' ' 61' ' ' LEU . . . -52.95 -30.01 32.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.869 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.99 -10.84 78.35 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.162 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.417 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 8.4 mm100 -112.74 -14.46 13.11 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.718 HD21 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -122.1 -178.69 3.93 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.281 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.541 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 9.6 m -124.31 101.71 7.32 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.581 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.434 HD12 HD12 ' A' ' 13' ' ' LEU . 11.7 mm -78.0 123.59 35.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.69 179.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.5 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -87.97 136.88 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 0.0 111.372 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -94.54 151.29 19.46 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.939 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.34 -26.7 22.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.434 ' CD2' HD13 ' A' ' 100' ' ' LEU . 12.9 t80 -98.83 132.62 44.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.527 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -158.26 133.59 8.73 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.187 0.517 . . . . 0.0 111.388 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -160.21 143.13 13.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.739 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.703 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.9 pm0 -129.65 128.53 42.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.932 0.396 . . . . 0.0 111.118 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.502 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.4 mt -89.99 118.25 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.222 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.435 HD21 ' HA ' ' A' ' 95' ' ' THR . 2.2 m120 -111.07 124.46 52.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.502 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.578 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 16.6 p90 -167.7 141.34 3.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.257 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.491 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.3 p -83.89 111.22 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.369 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.01 -102.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.796 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.462 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -64.07 -35.65 81.43 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.77 0.319 . . . . 0.0 111.01 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.462 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 2.6 p-10 173.19 30.72 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.856 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.646 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.92 126.09 2.63 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.78 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.635 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 59.3 Cg_endo -72.43 119.28 6.03 Favored 'Trans proline' 0 CA--C 1.512 -0.601 0 C-N-CA 123.136 2.557 . . . . 0.0 112.455 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.52 ' HG3' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -100.49 130.2 46.54 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.528 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.435 ' HA ' HD21 ' A' ' 86' ' ' ASN . 96.1 m -97.03 101.53 13.12 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.703 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 40.2 t -103.33 108.33 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.784 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.607 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.66 122.74 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.655 ' HB3' HG13 ' A' ' 14' ' ' ILE . 25.3 m-85 -110.66 128.18 55.59 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.184 0.516 . . . . 0.0 112.001 -178.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.551 ' CD2' HD11 ' A' ' 57' ' ' LEU . 10.9 m-90 -108.06 169.31 8.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.766 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.434 HD13 ' CD2' ' A' ' 81' ' ' PHE . 2.2 mt -101.52 109.06 20.8 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.541 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -118.75 151.73 37.48 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.093 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.448 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.9 tm-20 -131.3 115.16 15.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.12 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.718 HG13 HD21 ' A' ' 75' ' ' LEU . 6.0 m -71.97 131.44 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.291 0.567 . . . . 0.0 110.632 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 74' ' ' GLN . 4.7 mttt -67.81 -26.04 65.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.178 -178.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.733 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 58.4 t0 -104.16 125.14 50.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.951 0.405 . . . . 0.0 112.047 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -62.24 -42.84 99.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.892 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.9 23.2 9.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.743 178.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.733 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.5 p -43.49 148.08 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.326 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.57 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -62.95 140.98 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.31 0.576 . . . . 0.0 111.745 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.663 HG13 ' CE2' ' A' ' 119' ' ' TYR . 33.0 mm -124.23 96.75 4.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.684 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -99.42 101.43 12.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.855 -178.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 9.2 mt -97.09 125.04 41.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.297 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.6 p -65.25 -164.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.422 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -80.29 13.96 2.16 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.676 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -104.54 -35.4 7.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.015 0.436 . . . . 0.0 110.68 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.49 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 42.0 m80 -107.25 123.32 48.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.608 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.465 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 6.1 tp60 -92.5 -13.41 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.586 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -164.23 167.67 19.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.107 0.48 . . . . 0.0 111.761 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.663 ' CE2' HG13 ' A' ' 110' ' ' ILE . 40.8 p90 -146.63 168.54 21.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.512 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.438 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 18.8 mtt180 -156.08 156.55 34.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.136 0.493 . . . . 0.0 111.553 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.484 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 89.1 m95 -119.66 107.52 13.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.592 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.502 HD23 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -139.17 167.73 21.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.856 0.36 . . . . 0.0 111.601 -178.451 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -162.2 11.17 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.702 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 8.3 tp -67.92 -45.58 73.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.809 0.305 . . . . 0.0 111.048 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.412 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.4 pt-20 -55.14 -53.39 56.49 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.556 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.617 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.1 OUTLIER -68.81 -51.89 35.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.018 0.437 . . . . 0.0 109.84 179.659 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.474 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.25 -27.46 9.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.489 . . . . 0.0 109.782 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 124' ' ' LEU . 0.2 OUTLIER -83.0 -33.25 26.59 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.742 178.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.617 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -64.7 -45.83 84.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.788 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.59 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.2 mt -77.4 -36.98 52.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.199 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.781 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.67 49.66 1.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.648 179.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.77 -30.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.066 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.525 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 19.6 m-85 -65.0 127.19 30.59 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.58 -56.59 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.001 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.521 ' HG2' ' N6 ' ' A' ' 154' ' ' ATP . 0.0 OUTLIER -47.77 -50.17 26.43 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.089 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.781 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.36 -36.51 75.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.497 -179.433 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -62.13 -32.61 73.22 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.773 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.09 -46.3 35.54 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.699 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.451 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -52.65 -44.66 66.28 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.052 0.454 . . . . 0.0 110.527 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.72 -24.83 41.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.435 178.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.522 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.06 -52.11 46.21 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.523 -179.469 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -72.66 -30.85 64.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.44 -47.27 84.59 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.742 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.514 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -75.0 -35.11 62.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.085 0.469 . . . . 0.0 110.17 179.296 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -65.09 -52.94 52.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.686 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -63.89 -53.78 45.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 111.159 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.544 HD12 ' CE1' ' A' ' 16' ' ' PHE . 94.9 mt -55.86 -28.54 57.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.737 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 41.2 t -73.72 -8.37 55.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.522 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.85 -6.24 21.57 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 147' ' ' LEU . 0.0 OUTLIER -95.0 -141.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -137.1 -69.1 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.927 -179.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -146.77 -40.52 0.2 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.191 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.578 ' C2 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.525 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.37 85.64 1.06 Allowed 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.336 3.357 . . . . 0.0 109.586 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.04 130.53 46.83 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 110.958 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 110.88 55.85 0.51 Allowed Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.394 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.6 p -144.97 -100.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.616 0.246 . . . . 0.0 111.046 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.459 ' HG2' ' H ' ' A' ' 7' ' ' ALA . 8.4 ttp -75.15 165.53 25.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 120.86 0.362 . . . . 0.0 110.637 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 69.16 163.94 0.24 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.833 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -111.88 133.99 53.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.178 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.443 ' C ' HG11 ' A' ' 50' ' ' VAL . 3.6 ttt-85 -79.53 119.85 23.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.476 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -132.49 163.46 28.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.109 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 46.1 m -156.24 123.85 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.056 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.546 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.64 174.06 15.07 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.75 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.468 HD11 ' CD1' ' A' ' 77' ' ' ILE . 0.9 OUTLIER -124.95 118.15 25.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.126 0.463 . . . . 0.0 111.872 -179.229 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.661 HG13 ' HB3' ' A' ' 98' ' ' TYR . 52.3 mt -82.44 91.68 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.703 HD11 HD22 ' A' ' 32' ' ' LEU . 25.8 mt -83.75 146.46 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.1 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.645 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.45 122.68 7.16 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.657 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.543 ' CZ ' ' HG3' ' A' ' 30' ' ' GLU . 1.2 ppt_? -83.29 112.86 20.27 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.014 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.429 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 5.3 ttp180 -94.32 114.96 27.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.401 -179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 152.43 18.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.705 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.74 -80.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.7 pp -113.38 152.32 45.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.761 0.315 . . . . 0.0 111.267 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.05 150.53 88.38 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.39 2.06 . . . . 0.0 111.977 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.728 ' HB2' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -90.46 -72.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 m -133.67 -40.98 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -171.28 43.07 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.951 0.405 . . . . 0.0 111.38 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.728 HD22 ' HB2' ' A' ' 23' ' ' LYS . 1.6 p30 -124.87 121.45 34.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.966 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -42.36 153.46 0.07 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.557 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.5 76.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.947 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.645 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -116.09 137.28 50.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.178 0.513 . . . . 0.0 111.866 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.584 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -136.12 126.81 27.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.468 179.196 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.652 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.5 m-85 -86.75 147.41 25.86 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.703 HD22 HD11 ' A' ' 15' ' ' ILE . 42.5 tp -84.04 133.08 34.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.676 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.437 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.7 mt -134.32 137.25 44.07 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.951 0.405 . . . . 0.0 110.815 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.458 ' HB2' ' CE1' ' A' ' 116' ' ' HIS . 2.2 mt -120.73 105.09 10.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.634 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.491 ' HB2' ' CZ2' ' A' ' 43' ' ' TRP . 1.7 tt0 -59.49 132.77 55.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.212 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.65 135.54 57.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.42 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.461 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 19.0 p -80.95 10.77 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -164.98 -173.31 2.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.728 0.299 . . . . 0.0 110.438 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.95 -131.9 36.67 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.481 HD12 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -88.69 6.14 3.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.693 0.282 . . . . 0.0 111.462 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 58.03 44.56 19.28 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.807 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.481 ' HB3' HD12 ' A' ' 40' ' ' ILE . 6.9 p80 -67.93 174.42 3.74 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.185 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.56 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 81.0 m95 -120.2 101.99 8.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.638 179.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 71.5 p -126.37 154.32 74.85 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.563 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.511 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 63.4 Cg_endo -70.27 173.88 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.408 2.072 . . . . 0.0 111.969 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.64 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 21.9 Cg_exo -63.93 86.93 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.517 2.145 . . . . 0.0 112.082 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 1.2 pttt -96.21 152.26 18.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 111.054 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.14 -177.87 15.88 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.889 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.514 ' C ' HG23 ' A' ' 59' ' ' THR . 0.1 OUTLIER -107.0 115.92 31.02 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 110.504 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.526 ' N ' HG23 ' A' ' 59' ' ' THR . 1.5 p -90.42 128.84 42.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 121.241 0.543 . . . . 0.0 111.179 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.616 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 3.0 tt0 -92.06 153.51 43.3 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.799 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.616 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 5.2 Cg_endo -47.7 -43.21 29.06 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.968 2.445 . . . . 0.0 112.432 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.43 -15.21 78.77 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -83.53 164.42 19.82 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.798 0.332 . . . . 0.0 111.258 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.85 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 12.0 t70 -85.22 161.44 19.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.473 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.519 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 1.7 m-20 -72.64 -64.76 0.89 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.606 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.603 HD11 ' CD2' ' A' ' 99' ' ' TRP . 28.4 tp -63.43 -41.6 98.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.85 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.1 OUTLIER -49.86 -46.3 51.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.526 HG23 ' N ' ' A' ' 50' ' ' VAL . 55.1 m -55.8 -44.87 78.22 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -68.5 -30.06 68.81 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.927 178.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.575 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 91.7 mt -73.14 -52.42 14.25 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.26 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.1 84.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.327 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.58 -34.04 76.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.261 0.553 . . . . 0.0 109.806 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.64 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 39.6 m -59.12 -52.62 64.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.588 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.548 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.8 pt20 -74.59 -23.13 58.7 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.2 -35.45 48.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.899 0.38 . . . . 0.0 110.812 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.435 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 5.5 mt-10 -109.8 3.05 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.868 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -150.73 -6.97 0.28 Allowed 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.63 2.38 43.47 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 120.071 -1.061 . . . . 0.0 112.618 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.58 HG21 ' HB3' ' A' ' 74' ' ' GLN . 1.3 mt -105.85 128.16 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-O 120.878 0.371 . . . . 0.0 110.301 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.511 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 4.4 pm0 -112.19 172.23 7.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.482 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.512 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -52.67 -31.97 39.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.999 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.79 -6.42 81.76 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.175 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.762 HE22 ' HE2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -112.88 -14.36 13.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.548 0.213 . . . . 0.0 110.968 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.733 HD22 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -122.86 -171.07 2.21 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.528 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.6 m -130.91 98.78 4.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.251 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.521 ' CD1' ' HB3' ' A' ' 101' ' ' ALA . 12.3 mm -73.22 122.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.037 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.534 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -85.28 135.58 24.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -92.97 151.43 19.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.267 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.71 -23.18 37.09 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.524 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.452 ' CE1' HD22 ' A' ' 100' ' ' LEU . 19.8 t80 -102.13 126.11 49.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.841 0.353 . . . . 0.0 110.917 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.464 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.2 ttpt -158.1 125.18 4.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.191 0.52 . . . . 0.0 111.306 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.569 ' NE ' ' HE2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -146.9 137.54 23.76 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.612 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.72 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -121.08 127.5 51.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.991 0.424 . . . . 0.0 111.496 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.524 HD13 ' HE2' ' A' ' 98' ' ' TYR . 6.7 mt -92.73 117.34 29.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.225 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -107.02 123.76 48.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.3 -178.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.631 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 25.5 p90 -166.88 143.48 4.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.16 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.67 ' O ' HG11 ' A' ' 88' ' ' VAL . 11.0 p -84.31 111.42 20.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.541 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.4 -106.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.241 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -41.55 88.47 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.927 0.394 . . . . 0.0 110.763 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 177.9 29.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.732 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.621 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -155.48 125.84 3.38 Favored Pre-proline 0 N--CA 1.452 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.562 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.624 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 55.9 Cg_endo -70.53 119.99 6.77 Favored 'Trans proline' 0 CA--C 1.513 -0.544 0 C-N-CA 123.179 2.586 . . . . 0.0 112.481 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.449 ' HD2' ' CD2' ' A' ' 49' ' ' HIS . 6.0 ttpt -106.89 119.02 38.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.96 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.438 HG23 ' HB2' ' A' ' 84' ' ' GLU . 47.7 m -82.19 107.74 15.12 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.72 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 46.3 t -104.28 107.97 23.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.914 -178.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.611 HD12 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.47 131.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.661 ' HB3' HG13 ' A' ' 14' ' ' ILE . 6.1 m-85 -116.24 136.74 52.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.287 0.565 . . . . 0.0 112.135 -177.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.603 ' CD2' HD11 ' A' ' 57' ' ' LEU . 8.9 m-90 -125.01 140.91 52.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.238 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.502 ' O ' ' HA ' ' A' ' 77' ' ' ILE . 0.5 OUTLIER -74.76 132.21 41.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.709 -0.396 . . . . 0.0 109.936 179.171 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.553 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -141.15 135.75 31.16 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.821 0.343 . . . . 0.0 111.549 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.581 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.8 tm-20 -113.55 115.8 28.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.257 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.733 HG13 HD22 ' A' ' 75' ' ' LEU . 16.3 m -71.89 122.25 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-O 121.159 0.504 . . . . 0.0 110.447 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.421 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 1.3 mttt -64.05 -22.34 66.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.661 -178.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.87 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -100.91 111.46 23.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.27 0.557 . . . . 0.0 111.711 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -56.69 -39.14 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.65 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -105.76 28.07 7.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.551 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.87 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.3 p -48.18 149.08 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.699 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.762 ' HE2' HE22 ' A' ' 74' ' ' GLN . 2.1 pm0 -72.24 144.0 48.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 110.577 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.602 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.6 mm -121.66 94.59 3.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.659 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.459 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.3 OUTLIER -97.59 98.61 10.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.715 -179.405 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.453 HD22 HD23 ' A' ' 34' ' ' LEU . 6.0 mt -83.09 174.64 10.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 24.7 p -116.18 -167.72 1.32 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -59.94 -43.48 94.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.997 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.37 -4.52 18.68 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.458 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 40.1 m-70 -120.99 144.45 48.5 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 111.314 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.461 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 2.4 pt20 -127.53 -18.12 4.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.628 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.72 154.89 18.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.939 0.399 . . . . 0.0 111.421 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.602 ' CE2' HG13 ' A' ' 110' ' ' ILE . 37.8 p90 -136.65 168.15 20.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.41 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' A' ' 119' ' ' TYR . 6.7 mtt180 -156.19 159.85 39.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.134 0.492 . . . . 0.0 111.598 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.3 m95 -121.33 109.28 14.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.644 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.561 HD21 HD13 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -138.32 168.33 19.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.028 0.442 . . . . 0.0 111.623 -178.712 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -74.56 -153.34 3.28 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.714 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.1 tp -77.13 -43.15 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.808 0.337 . . . . 0.0 111.063 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -59.19 -48.9 79.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.837 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.788 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.67 -41.0 63.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.933 0.397 . . . . 0.0 110.851 -179.376 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.437 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -61.22 -29.56 69.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.263 0.554 . . . . 0.0 109.515 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.3 -33.5 23.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.502 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.788 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.71 -42.73 95.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.636 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.613 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -77.35 -43.12 34.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.719 ' HB3' ' HB3' ' A' ' 136' ' ' MET . . . -79.71 57.71 2.58 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.73 178.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.5 -36.94 0.18 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.929 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.521 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 6.9 m-85 -54.62 118.98 4.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.766 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.09 -51.95 12.95 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.106 0.479 . . . . 0.0 110.605 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.541 ' HG2' ' N6 ' ' A' ' 154' ' ' ATP . 0.0 OUTLIER -50.95 -53.35 33.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.564 179.917 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.719 ' HB3' ' HB3' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.74 -37.17 78.24 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -61.25 -34.95 76.0 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.65 -46.17 55.33 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.895 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -51.74 -45.71 63.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.099 0.475 . . . . 0.0 110.004 179.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.39 -29.69 57.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.525 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.22 -52.45 47.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.171 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.569 ' HE2' ' NE ' ' A' ' 83' ' ' ARG . 19.6 mt-10 -69.35 -30.63 68.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.422 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.16 -44.67 88.74 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.657 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.501 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 3.5 t-80 -78.19 -34.23 49.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.748 0.309 . . . . 0.0 110.351 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -61.82 -52.77 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.482 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.493 ' CE2' HD13 ' A' ' 150' ' ' ILE . 65.4 t80 -63.64 -50.43 69.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.105 0.479 . . . . 0.0 110.694 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.534 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.4 mt -57.21 -34.65 68.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.791 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -73.5 -17.48 61.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.697 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.34 -10.41 35.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.718 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.501 HD11 HG22 ' A' ' 150' ' ' ILE . 0.9 OUTLIER -84.09 -130.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.95 -52.34 2.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.855 0.359 . . . . 0.0 110.936 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -54.83 138.09 43.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.487 ' C ' HD21 ' A' ' 153' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.952 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.631 ' C2 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.415 ' HA2' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.549 0 N-CA-C 110.25 -1.14 . . . . 10.92 110.25 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.552 ' HG2' HD21 ' A' ' 3' ' ' LEU . 83.0 Cg_endo -72.41 -177.95 3.03 Favored 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 124.313 3.342 . . . . 8.94 109.595 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.552 HD21 ' HG2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER 77.8 -48.63 0.49 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.99 -0.55 . . . . 8.39 111.731 179.843 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.87 16.22 77.56 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.856 -0.688 . . . . 4.63 112.247 -179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 62.0 m -119.73 18.16 12.67 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.534 0.198 . . . . 3.84 111.534 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.433 ' HE3' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -52.73 111.66 0.7 Allowed 'General case' 0 C--N 1.345 0.371 0 N-CA-C 109.254 -0.647 . . . . 3.74 109.254 179.32 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.707 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 73.3 136.23 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.574 -0.739 . . . . 1.39 109.907 -177.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.643 HD13 ' HB3' ' A' ' 92' ' ' LYS . 1.0 OUTLIER -72.26 125.73 28.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.655 -1.157 . . . . 1.53 111.618 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' HB3' HG12 ' A' ' 50' ' ' VAL . 4.9 ttt180 -78.47 111.53 14.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 3.07 110.057 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -129.02 168.38 16.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.776 -0.647 . . . . 1.23 110.796 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.444 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.1 m -157.11 122.41 4.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.71 110.905 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.99 171.98 14.09 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.557 -0.747 . . . . 0.47 111.421 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.433 ' HG ' ' HB1' ' A' ' 60' ' ' ALA . 0.9 OUTLIER -126.61 117.11 22.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.987 0.394 . . . . 1.13 111.103 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.531 HG13 ' HB3' ' A' ' 98' ' ' TYR . 84.3 mt -82.79 91.2 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.091 -1.077 . . . . 1.3 108.091 177.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.604 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 18.2 mt -78.44 145.39 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 114.913 -1.04 . . . . 1.08 111.087 -178.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.691 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.5 p90 -149.12 121.38 8.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 123.431 0.457 . . . . 2.13 111.49 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.94 111.64 17.59 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.791 -0.448 . . . . 4.98 109.791 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -98.46 134.25 41.7 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.107 -0.497 . . . . 3.22 111.247 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.85 160.13 14.53 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.031 -0.531 . . . . 1.72 110.616 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -63.49 1.28 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.403 -0.362 . . . . 3.12 110.876 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.412 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 1.9 pp -133.19 150.18 74.66 Favored Pre-proline 0 C--O 1.232 0.169 0 CA-C-N 116.286 -0.416 . . . . 2.49 111.364 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 20.0 Cg_exo -66.32 151.36 83.52 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.916 2.41 . . . . 2.38 112.41 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.47 -70.19 0.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.139 -0.482 . . . . 4.28 110.559 179.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.9 t -111.41 11.34 8.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.006 -0.543 . . . . 3.84 111.322 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.66 38.17 15.45 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.9 0.381 . . . . 5.3 111.122 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -100.2 -69.58 0.76 Allowed 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.465 . . . . 4.68 111.103 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -139.53 104.5 4.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.008 -0.542 . . . . 3.59 111.051 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -86.77 -30.96 21.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.996 -0.547 . . . . 1.31 110.971 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.691 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.8 mt -121.4 135.31 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-N 116.052 -0.522 . . . . 1.22 111.389 -179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.3 120.93 28.07 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.087 -0.506 . . . . 1.91 110.248 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.59 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 47.1 m-85 -82.1 149.62 27.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 2.19 112.209 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.604 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 52.4 tp -87.18 134.07 33.57 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.743 -0.662 . . . . 1.07 110.032 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.538 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.2 mt -133.69 134.64 43.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.34 -0.391 . . . . 1.13 111.085 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.44 HD13 ' HG3' ' A' ' 46' ' ' PRO . 20.7 mt -113.0 113.43 25.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.074 -0.512 . . . . 1.14 110.803 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -69.62 144.35 53.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.892 -0.594 . . . . 1.69 111.606 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.37 139.01 43.78 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.972 -0.558 . . . . 1.39 110.362 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.458 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 91.9 p -74.27 -20.58 60.1 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.034 0.383 . . . . 1.98 112.034 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.51 177.74 8.25 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.764 0.316 . . . . 2.83 111.452 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.95 -120.54 5.18 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.078 -0.582 . . . . 1.46 112.664 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.431 ' O ' ' CG1' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -98.01 -6.61 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 120.542 0.211 . . . . 1.96 110.892 179.59 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 67.97 39.81 2.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.064 0.459 . . . . 1.64 110.754 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -72.0 144.52 48.8 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.914 -0.585 . . . . 1.66 110.834 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.547 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 56.8 m95 -95.03 122.59 37.85 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.079 -0.509 . . . . 0.65 110.852 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -145.17 144.68 24.25 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.003 -0.544 . . . . 1.2 110.9 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.48 171.61 3.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.775 2.316 . . . . 1.15 112.221 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.531 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 19.8 Cg_exo -65.04 101.86 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.626 2.217 . . . . 0.71 112.264 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.14 142.87 30.07 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.207 -0.452 . . . . 2.39 110.97 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.55 176.71 18.13 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.104 -0.57 . . . . 0.78 112.56 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.1 103.89 12.68 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.726 0.298 . . . . 3.59 110.63 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.475 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.3 p -79.31 121.43 32.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 121.113 0.483 . . . . 1.45 111.106 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.41 158.38 54.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.5 -0.773 . . . . 1.98 109.978 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.73 -53.59 6.34 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.927 2.418 . . . . 1.61 112.453 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.84 -13.24 83.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 121.014 -0.612 . . . . 1.28 113.189 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -81.87 155.33 25.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.884 0.342 . . . . 1.43 111.114 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.807 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 34.9 t70 -79.27 158.3 27.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.244 -0.434 . . . . 1.33 110.702 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.45 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -69.3 -62.32 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.852 -0.613 . . . . 1.74 111.598 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.466 HD12 ' CE3' ' A' ' 99' ' ' TRP . 9.1 tp -62.51 -40.23 96.06 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.789 -0.187 . . . . 1.22 111.485 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.807 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -51.6 -40.76 60.43 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.972 0.17 . . . . 1.91 110.692 179.657 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.475 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 96.3 m -61.9 -46.96 87.09 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 110.057 -0.349 . . . . 1.29 110.057 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.433 ' HB1' ' HG ' ' A' ' 13' ' ' LEU . . . -62.24 -43.23 99.31 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 109.63 -0.507 . . . . 1.11 109.63 178.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.584 HD23 HD13 ' A' ' 77' ' ' ILE . 97.9 mt -60.39 -52.77 63.81 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.371 -0.831 . . . . 1.16 110.901 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -42.62 85.86 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.868 -0.606 . . . . 3.55 110.809 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.44 -35.64 79.89 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.29 -0.413 . . . . 1.14 111.098 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.532 HG22 ' CD1' ' A' ' 15' ' ' ILE . 63.5 m -63.99 -43.28 96.17 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.192 -0.458 . . . . 1.05 111.208 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.571 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 3.9 pt20 -80.08 -24.64 40.48 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.536 0.199 . . . . 2.22 111.536 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -79.93 -46.05 17.43 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.695 -0.23 . . . . 1.77 111.465 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 21.9 mt-10 -97.81 -11.45 23.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.679 0.622 . . . . 2.0 112.679 -179.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.511 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -131.96 -3.46 3.6 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.83 0.678 . . . . 1.07 112.83 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.402 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 69.65 6.34 54.77 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.391 -0.909 . . . . 0.39 113.546 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.571 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.4 mt -111.09 120.12 61.07 Favored 'Isoleucine or valine' 0 C--N 1.341 0.23 0 CA-C-N 117.378 0.589 . . . . 1.09 111.346 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.6 pt-20 -97.0 172.27 7.96 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 1.82 110.642 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.494 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -50.68 -42.01 56.36 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.998 0.37 . . . . 1.09 111.998 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.78 -25.7 71.87 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 120.998 -0.62 . . . . 0.48 112.742 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.532 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 5.9 tp60 -86.87 2.86 47.72 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 111.773 0.286 . . . . 2.09 111.773 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.611 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -139.48 -164.34 1.66 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.663 0.268 . . . . 1.1 110.5 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.419 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.4 m -143.02 100.85 3.72 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.331 -0.395 . . . . 1.18 110.168 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.584 HD13 HD23 ' A' ' 61' ' ' LEU . 9.2 mm -75.11 118.06 20.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.99 -0.55 . . . . 1.18 111.414 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.573 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -78.7 136.93 22.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.712 -0.677 . . . . 1.21 110.682 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.99 146.96 23.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.423 -0.808 . . . . 1.5 111.129 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.98 -28.36 15.61 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.822 -0.704 . . . . 0.79 113.063 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -98.88 128.91 45.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 2.17 111.633 -179.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -158.25 126.87 5.48 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.707 -0.679 . . . . 1.9 110.655 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -152.01 129.57 11.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.586 . . . . 3.54 110.75 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.811 ' HB3' HD12 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -110.74 137.49 48.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.886 0.374 . . . . 1.42 111.248 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.419 ' CD1' ' HB2' ' A' ' 135' ' ' GLU . 8.8 mt -102.2 121.61 42.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.781 -0.645 . . . . 1.24 110.553 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -110.27 127.26 54.91 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.301 -0.409 . . . . 1.75 111.773 -178.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.611 ' HB2' ' N1 ' ' A' ' 154' ' ' ATP . 14.5 p90 -167.3 141.6 3.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.788 -0.642 . . . . 2.35 111.428 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.477 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.9 p -82.77 112.6 20.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.49 -0.559 . . . . 1.54 109.49 177.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.76 -91.56 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.34 -0.391 . . . . 1.39 111.38 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -82.69 -44.76 15.3 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.877 0.37 . . . . 4.16 110.09 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -169.95 31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.869 -0.605 . . . . 2.79 111.0 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.643 ' HB3' HD13 ' A' ' 8' ' ' LEU . 8.7 tptt -161.16 126.19 2.17 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.981 0.42 . . . . 2.63 110.904 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.707 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 55.6 Cg_endo -66.41 121.34 8.59 Favored 'Trans proline' 0 N--CA 1.476 0.457 0 C-N-CA 123.745 2.963 . . . . 0.95 112.715 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.566 ' HG2' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -101.69 121.33 41.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.002 -0.545 . . . . 2.11 111.713 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.1 m -92.76 106.25 18.25 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.93 -0.767 . . . . 1.38 108.93 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.0 t -107.01 106.46 20.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 111.735 0.272 . . . . 1.15 111.735 -178.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.811 HD12 ' HB3' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -87.0 124.63 40.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.259 -0.645 . . . . 1.37 109.259 178.517 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.531 ' HB3' HG13 ' A' ' 14' ' ' ILE . 45.5 m-85 -109.01 158.04 18.1 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.876 0.695 . . . . 2.14 112.876 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.466 ' CE3' HD12 ' A' ' 57' ' ' LEU . 15.2 m-90 -141.39 157.98 44.47 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 114.762 -1.108 . . . . 0.79 109.82 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.573 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 2.0 mt -92.63 108.29 19.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.679 0.276 . . . . 1.18 110.261 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.469 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -117.97 125.29 50.11 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.432 -0.349 . . . . 1.08 110.645 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.517 ' HB2' ' CZ ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -104.93 113.89 27.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 1.38 111.093 -179.377 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.611 HG13 HD23 ' A' ' 75' ' ' LEU . 10.2 m -72.61 125.63 31.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 121.127 0.489 . . . . 1.16 110.404 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.5 ' HE2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -70.37 -16.49 62.98 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.667 -0.697 . . . . 1.97 112.646 -178.338 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.715 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 1.1 t70 -105.05 129.85 53.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.757 0.313 . . . . 2.39 111.042 179.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.4 -41.04 73.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 3.25 109.932 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.83 32.07 3.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.785 -0.643 . . . . 2.29 110.325 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.715 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.6 p -52.14 140.61 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 115.93 -0.577 . . . . 1.1 110.33 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -62.0 140.65 58.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.259 0.552 . . . . 1.26 111.693 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.58 HG13 ' CE2' ' A' ' 119' ' ' TYR . 41.4 mm -120.39 98.84 6.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.245 -0.889 . . . . 1.17 110.012 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.402 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 5.4 mtt180 -101.01 98.48 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.532 -0.758 . . . . 3.78 110.844 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.468 ' HA ' ' O ' ' A' ' 67' ' ' GLU . 6.4 mt -87.67 146.0 25.9 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.589 -0.732 . . . . 1.17 111.73 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.2 m -91.07 -172.35 3.29 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.709 -0.678 . . . . 2.07 110.718 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -60.28 -28.77 68.35 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.718 -0.219 . . . . 3.52 111.531 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.75 -44.52 73.58 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 111.798 0.295 . . . . 2.63 111.798 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -104.34 123.75 47.96 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 2.17 111.498 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 4.0 pt20 -95.42 -26.34 15.9 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.076 -0.511 . . . . 3.28 111.814 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -141.61 168.12 20.52 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.03 0.443 . . . . 1.31 111.654 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.58 ' CE2' HG13 ' A' ' 110' ' ' ILE . 31.5 p90 -148.24 161.78 40.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.71 -0.677 . . . . 2.24 110.635 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -153.78 153.97 33.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.139 0.495 . . . . 2.71 111.655 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -117.28 106.94 13.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.256 -0.884 . . . . 0.48 109.049 178.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.53 HD21 HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -135.42 168.77 18.59 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.938 0.399 . . . . 1.17 111.829 -178.117 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.48 -158.13 6.95 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.835 -0.621 . . . . 0.47 112.209 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 8.4 tp -72.71 -45.79 56.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.596 0.198 . . . . 1.22 111.17 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.419 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.6 pt-20 -58.36 -48.65 79.9 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.128 0.418 . . . . 1.34 112.128 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.734 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.03 -42.09 60.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.689 -0.232 . . . . 1.28 111.041 -179.465 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.538 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.99 -31.01 69.51 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.844 -0.428 . . . . 1.1 109.844 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.65 -37.56 35.7 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.62 -0.718 . . . . 1.81 110.263 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.734 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -59.47 -42.67 92.57 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.402 -0.363 . . . . 1.29 111.042 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.592 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -78.22 -42.51 31.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.348 -0.387 . . . . 1.18 110.849 179.174 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.681 ' HB3' ' HB3' ' A' ' 136' ' ' MET . . . -79.04 56.41 1.98 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.202 0.525 . . . . 1.07 109.858 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.31 -39.48 0.28 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.824 -1.08 . . . . 3.28 111.951 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.852 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 56.5 m-85 -56.08 120.39 7.41 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.18 -0.464 . . . . 2.34 109.877 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -57.21 4.35 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.931 0.715 . . . . 2.33 112.931 -177.502 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.852 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 0.0 OUTLIER -47.58 -47.2 28.61 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.177 0.298 . . . . 1.71 111.391 -179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.681 ' HB3' ' HB3' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.07 -46.75 87.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.196 -0.298 . . . . 1.16 110.196 179.835 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -40.92 72.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.893 -0.594 . . . . 2.01 110.078 178.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.8 -41.88 74.47 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-N 115.97 -0.559 . . . . 1.21 111.143 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -56.51 -46.89 80.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.95 0.405 . . . . 1.11 109.967 179.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.434 HD13 ' O ' ' A' ' 136' ' ' MET . 1.5 mt -71.76 -31.16 66.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.625 -0.716 . . . . 1.1 110.042 178.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.49 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.89 -51.75 56.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.918 -0.583 . . . . 1.19 111.187 179.579 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.56 -31.7 71.11 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.097 -0.501 . . . . 2.28 110.928 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -60.2 -46.09 94.87 Favored Glycine 0 C--N 1.338 0.662 0 C-N-CA 120.786 -0.721 . . . . 0.49 111.655 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -72.12 -36.09 69.31 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.551 0.215 . . . . 1.94 110.537 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -64.7 -52.71 55.72 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.276 -0.42 . . . . 2.15 111.441 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -56.66 -51.38 68.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.084 -0.507 . . . . 2.22 111.065 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.692 HD21 HD12 ' A' ' 150' ' ' ILE . 87.5 mt -59.13 -37.26 76.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.112 -0.494 . . . . 1.24 111.671 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 2.0 t -70.45 -19.33 62.97 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.615 0.245 . . . . 1.31 110.72 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -12.14 48.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.372 -0.376 . . . . 1.42 111.503 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.692 HD12 HD21 ' A' ' 147' ' ' LEU . 1.7 mt -79.68 -128.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 110.093 -0.336 . . . . 1.41 110.093 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -136.2 -61.51 0.7 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 117.934 0.334 . . . . 3.45 111.009 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -156.6 -49.88 0.07 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.216 -0.447 . . . . 3.59 111.251 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 2.6 mt . . . . . 0 N--CA 1.464 0.258 0 CA-C-N 116.265 -0.425 . . . . 7.34 111.218 179.995 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.611 ' N1 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -72.37 149.82 51.33 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 C-N-CA 124.283 3.322 . . . . 0.0 109.625 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.08 97.48 0.09 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.902 0.382 . . . . 0.0 110.757 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -144.09 -146.47 4.52 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.246 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.0 t -88.07 2.14 52.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.9 ttp 60.82 158.32 0.04 OUTLIER 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 -179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.578 ' HB1' ' HG2' ' A' ' 93' ' ' PRO . . . 62.8 174.52 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 110.707 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.591 HD12 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -114.47 126.17 54.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.517 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HB3' HG12 ' A' ' 50' ' ' VAL . 0.8 OUTLIER -78.19 123.82 27.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -142.83 160.03 41.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.122 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.462 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 80.0 m -150.72 123.79 8.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.176 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.404 ' O ' ' CB ' ' A' ' 60' ' ' ALA . . . -111.74 177.25 18.74 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.491 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -130.26 118.18 20.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.589 0.695 . . . . 0.0 112.328 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.524 HG13 ' HB3' ' A' ' 98' ' ' TYR . 78.8 mt -82.64 91.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.552 ' HB ' ' HB3' ' A' ' 32' ' ' LEU . 27.5 mt -81.51 145.9 8.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.339 -178.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.632 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 35.5 p90 -152.94 127.27 9.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.372 -178.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.486 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.08 113.02 23.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.006 0.431 . . . . 0.0 110.119 178.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.12 125.06 34.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.466 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -83.85 154.87 23.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.379 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.7 mt -59.48 -81.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.771 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.572 HD12 ' HE2' ' A' ' 23' ' ' LYS . 2.8 pp -109.07 150.37 40.88 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.638 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.48 152.45 81.85 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.677 2.252 . . . . 0.0 112.408 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.572 ' HE2' HD12 ' A' ' 21' ' ' ILE . 0.1 OUTLIER -122.7 -78.8 0.6 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.778 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.4 t -86.95 -9.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.699 -179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 64.76 22.67 12.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.85 0.357 . . . . 0.0 110.811 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -73.99 -78.9 0.09 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.498 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -123.17 -31.75 3.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.851 179.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 73.86 -54.61 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.533 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.573 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.8 mt -102.39 149.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.705 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.632 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.8 mp0 -116.7 172.65 7.09 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.036 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 27.9 m-85 -135.14 129.11 33.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.564 0.221 . . . . 0.0 111.14 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.552 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.9 tp -71.95 133.08 45.15 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.444 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 4.0 mt -133.99 144.74 48.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.729 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HB3' ' CG ' ' A' ' 116' ' ' HIS . 51.7 mt -123.41 109.73 14.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.065 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.475 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 5.1 tt0 -72.62 143.38 48.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.423 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.82 176.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.636 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.516 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 21.7 p -103.36 -9.73 19.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.562 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -164.0 -172.96 2.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.777 0.322 . . . . 0.0 110.69 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.38 -123.96 7.02 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.351 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.515 ' O ' HG12 ' A' ' 40' ' ' ILE . 8.9 tt -90.46 -3.65 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.767 0.318 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.97 29.77 16.44 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.78 0.324 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.427 ' HB3' HG22 ' A' ' 40' ' ' ILE . 36.4 p-80 -57.3 151.74 15.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.576 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.661 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.8 m95 -103.91 140.93 37.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.305 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.43 141.8 6.22 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.901 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.5 Cg_endo -66.42 169.11 14.68 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.367 2.044 . . . . 0.0 111.896 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.604 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 51.7 Cg_exo -51.69 103.98 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.594 2.196 . . . . 0.0 112.644 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.61 124.05 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.967 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.406 ' CA ' ' HB3' ' A' ' 63' ' ' ALA . . . -111.26 169.68 13.39 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.322 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -118.25 104.84 11.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.702 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.652 ' N ' HG22 ' A' ' 59' ' ' THR . 1.5 p -76.56 129.29 37.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.425 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.639 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -91.48 177.36 2.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.408 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.639 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.5 Cg_exo -57.34 -54.2 3.81 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.402 2.068 . . . . 0.0 112.87 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.23 3.73 86.56 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.373 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.56 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 21.6 tt0 -84.43 171.24 12.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.901 0.35 . . . . 0.0 110.736 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.87 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.7 t70 -97.06 157.73 15.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.273 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.512 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 12.9 m-20 -70.04 -64.92 0.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.281 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.576 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 22.7 tp -62.79 -42.93 99.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.113 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.87 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -49.35 -43.08 43.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.543 -179.794 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.652 HG22 ' N ' ' A' ' 50' ' ' VAL . 25.9 m -58.56 -45.26 89.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.412 ' HA ' ' O ' ' A' ' 11' ' ' CYS . . . -69.04 -30.04 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.823 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 88.4 mt -72.93 -51.85 16.91 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.118 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -41.71 95.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.802 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HB3' ' CA ' ' A' ' 48' ' ' GLY . . . -61.39 -39.57 91.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.173 0.511 . . . . 0.0 109.826 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.604 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 87.5 m -58.18 -47.03 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.891 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.46 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 13.2 pt20 -80.0 -25.15 40.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.978 0.418 . . . . 0.0 110.484 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -30.06 50.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.718 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.571 ' O ' HD23 ' A' ' 112' ' ' LEU . 69.2 mm-40 -107.68 -27.07 10.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.772 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.448 ' HB2' HD23 ' A' ' 32' ' ' LEU . . . -121.8 -7.93 8.98 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.834 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 79.49 -8.87 45.33 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 119.712 -1.232 . . . . 0.0 112.77 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.584 ' O ' HG23 ' A' ' 64' ' ' THR . 2.6 mt -93.82 132.71 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 120.866 0.365 . . . . 0.0 110.468 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pt-20 -116.52 170.18 8.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.21 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.509 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.5 -39.53 10.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.47 -21.66 68.89 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.435 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.443 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 7.1 tp60 -100.66 -3.39 30.42 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.532 ' HA ' ' HA ' ' A' ' 103' ' ' VAL . 0.0 OUTLIER -133.03 -170.9 2.55 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 178.211 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.553 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 57.4 m -136.36 98.18 3.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 111.617 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.521 HD11 ' CD2' ' A' ' 61' ' ' LEU . 5.7 mm -69.28 127.89 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.137 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.407 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -92.43 137.76 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -97.98 151.3 20.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.126 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.11 -31.22 8.9 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.975 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.474 ' CD1' HD23 ' A' ' 100' ' ' LEU . 10.3 t80 -103.64 105.17 15.32 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 120.894 0.378 . . . . 0.0 110.72 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -135.68 122.35 20.94 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.339 0.59 . . . . 0.0 110.639 179.589 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -140.9 148.33 40.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.917 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.702 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 3.8 pm0 -133.06 125.36 29.45 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.431 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.451 HD13 ' HE2' ' A' ' 98' ' ' TYR . 7.2 mt -91.95 116.68 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.046 179.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.459 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.81 129.92 56.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.829 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.567 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 19.4 p90 -166.75 141.76 4.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.667 ' O ' HG11 ' A' ' 88' ' ' VAL . 7.7 p -81.99 111.42 18.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.847 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.48 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.887 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -37.47 18.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.066 0.46 . . . . 0.0 110.932 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 177.64 26.44 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.534 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.591 ' HB3' HD12 ' A' ' 8' ' ' LEU . 2.7 tptt -155.11 120.85 2.62 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.578 ' HG2' ' HB1' ' A' ' 7' ' ' ALA . 43.4 Cg_endo -68.73 117.84 5.27 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.372 2.715 . . . . 0.0 113.053 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.527 ' CD ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -100.58 115.46 30.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.985 -179.356 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.509 HG23 ' HB2' ' A' ' 84' ' ' GLU . 48.0 m -86.28 120.75 27.97 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.702 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.2 t -116.67 108.12 24.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.014 -0.275 . . . . 0.0 111.692 -178.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.583 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -84.52 125.63 40.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.524 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.4 m-85 -113.15 130.75 56.1 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.144 -177.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.561 ' CD2' HD12 ' A' ' 57' ' ' LEU . 3.7 m-90 -114.9 156.86 24.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.698 178.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.474 HD23 ' CD1' ' A' ' 81' ' ' PHE . 2.1 mt -93.18 113.13 25.28 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.553 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -124.81 148.94 47.9 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.966 0.412 . . . . 0.0 111.788 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.597 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.2 OUTLIER -123.38 117.94 26.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.129 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.532 ' HA ' ' HA ' ' A' ' 75' ' ' LEU . 7.6 m -71.94 132.61 33.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.853 0.358 . . . . 0.0 110.367 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.85 -20.68 66.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.702 -178.283 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.707 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 60.3 t0 -111.89 120.57 42.38 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.486 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 8.1 t80 -58.98 -38.12 78.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.353 178.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -105.69 26.1 9.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.996 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.707 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.6 p -43.3 149.02 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.456 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.553 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -70.21 142.93 52.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.222 0.535 . . . . 0.0 111.298 -179.099 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.618 HG13 ' CE2' ' A' ' 119' ' ' TYR . 46.1 mm -120.15 99.67 7.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.758 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.834 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 3.9 mtp180 -98.77 100.4 11.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.913 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.571 HD23 ' O ' ' A' ' 67' ' ' GLU . 14.0 mt -90.3 153.7 20.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.43 ' HG ' ' HE2' ' A' ' 67' ' ' GLU . 0.6 OUTLIER -113.77 -166.84 1.13 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.501 179.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.0 m80 -68.21 -1.45 6.16 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.557 ' HB2' ' HE2' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -91.37 -27.65 18.21 Favored 'General case' 0 C--N 1.335 -0.051 0 CA-C-O 120.838 0.351 . . . . 0.0 110.722 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.519 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 23.5 m80 -127.15 141.38 51.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.689 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.516 ' HB2' ' HA ' ' A' ' 37' ' ' SER . 5.0 tp-100 -100.58 -17.64 16.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.082 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.44 169.44 13.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.971 0.415 . . . . 0.0 111.515 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.618 ' CE2' HG13 ' A' ' 110' ' ' ILE . 35.9 p90 -140.42 174.96 10.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.112 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.56 163.07 33.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.313 0.578 . . . . 0.0 111.682 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.471 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 72.4 m95 -128.83 107.67 9.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.047 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.535 HD22 HD11 ' A' ' 130' ' ' LEU . 0.0 OUTLIER -142.43 166.68 24.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.18 0.514 . . . . 0.0 111.819 -178.185 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.32 -151.34 1.72 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.313 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.1 tp -76.98 -47.19 21.47 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.923 0.392 . . . . 0.0 111.19 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -56.88 -51.79 67.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.787 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.78 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.96 -48.93 61.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.949 0.404 . . . . 0.0 110.787 -179.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.438 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.66 -29.24 52.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.323 0.582 . . . . 0.0 109.926 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.1 m -84.46 -32.58 23.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.407 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.78 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.64 -43.56 84.31 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.808 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.661 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.1 mt -77.42 -42.91 34.38 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.2 51.86 1.24 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.93 -29.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.707 -179.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.504 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 13.7 m-85 -60.47 119.84 8.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.327 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.48 -48.37 19.1 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.876 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.495 ' CD ' HN62 ' A' ' 154' ' ' ATP . 34.0 mp0 -48.16 -54.58 12.89 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.666 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.515 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -65.13 -42.17 94.13 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.33 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.61 -39.32 61.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.059 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.28 -46.75 60.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.771 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.477 ' HB1' HD12 ' A' ' 14' ' ' ILE . . . -51.4 -49.76 60.95 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.665 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.94 -32.02 64.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.953 178.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.515 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -59.66 -52.29 66.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.248 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.401 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 3.0 mt-10 -71.55 -27.48 63.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.949 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.98 -42.73 92.97 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.894 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.448 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -76.27 -36.58 58.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.016 0.436 . . . . 0.0 110.22 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -63.48 -52.6 60.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.05 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.401 ' CD1' HD12 ' A' ' 150' ' ' ILE . 25.1 t80 -65.33 -51.95 57.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.463 -179.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.591 HD11 ' CE2' ' A' ' 16' ' ' PHE . 75.5 mt -56.96 -25.16 57.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.886 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.4 t -78.39 -18.64 54.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.747 0.308 . . . . 0.0 110.611 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.16 -12.21 36.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.697 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.464 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 0.8 OUTLIER -84.78 -130.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.101 179.57 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -170.22 -58.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.965 0.412 . . . . 0.0 110.555 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -159.68 -50.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.946 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.567 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.85 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.504 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.85 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 82.6 Cg_endo -72.39 171.88 16.11 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 124.315 3.344 . . . . 0.0 109.62 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.4 HD22 ' OG ' ' A' ' 5' ' ' SER . 1.2 tt -59.81 128.66 38.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.902 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.17 83.82 0.34 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.754 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.4 ' OG ' HD22 ' A' ' 3' ' ' LEU . 67.3 p -169.41 -23.33 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.523 0.202 . . . . 0.0 111.42 179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -72.86 125.36 27.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.795 0.331 . . . . 0.0 110.531 179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.619 ' HB1' ' HG2' ' A' ' 93' ' ' PRO . . . 62.91 174.3 0.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.109 0.481 . . . . 0.0 110.925 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.702 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.24 139.42 44.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.208 179.2 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.5 ' HB3' HG11 ' A' ' 50' ' ' VAL . 2.5 mtt180 -82.8 125.02 30.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.366 -179.508 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -137.64 165.93 25.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.991 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.452 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 9.6 m -160.59 123.82 3.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.298 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.545 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.02 172.3 14.16 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.72 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.559 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -125.46 117.92 24.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -179.432 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.688 HG13 ' HB3' ' A' ' 98' ' ' TYR . 43.2 mt -83.74 92.02 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.632 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 18.2 mt -82.45 146.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.982 -178.211 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.727 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 53.7 p90 -152.24 121.41 6.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.278 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.452 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 2.5 ptm180 -82.16 114.69 20.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.224 0.535 . . . . 0.0 110.25 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 23.8 ttp85 -98.08 124.07 42.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.248 -179.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 160.16 28.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.606 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -50.38 -54.22 23.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.123 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.7 pp -146.2 150.15 40.58 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.222 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.08 157.79 60.0 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.657 2.238 . . . . 0.0 112.184 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.65 -80.0 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.772 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.6 t -91.2 -10.81 9.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.064 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 t0 71.48 7.96 6.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.184 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.1 t-20 -81.46 -80.01 0.16 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.806 0.336 . . . . 0.0 110.189 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -108.56 97.06 6.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.071 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.6 -46.6 3.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.404 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.727 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.2 mt -107.64 143.87 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 111.905 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.605 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -132.79 126.84 33.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.104 179.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.632 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.3 m-85 -89.71 151.68 21.73 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 47.8 tp -86.72 133.99 33.63 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.0 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.555 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.3 mt -135.23 144.33 46.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.568 HD11 ' HB3' ' A' ' 67' ' ' GLU . 14.4 mt -123.61 113.24 18.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.086 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.494 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.5 tt0 -74.1 140.48 45.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.209 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.98 157.06 22.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.505 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.507 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 3.0 p -82.81 1.93 36.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.468 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -164.82 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.31 -121.3 7.46 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.343 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.512 ' O ' HG12 ' A' ' 40' ' ' ILE . 13.5 tt -93.44 0.55 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.819 0.342 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 58.67 32.51 22.25 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.886 0.374 . . . . 0.0 110.799 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 -67.02 142.12 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.764 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.68 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 46.6 m95 -98.71 140.79 32.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.67 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.41 ' HB ' ' HZ1' ' A' ' 47' ' ' LYS . 0.7 OUTLIER -163.27 142.59 6.66 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 -179.718 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 175.95 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.383 2.055 . . . . 0.0 112.105 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.683 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 6.8 Cg_exo -73.3 102.4 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.851 2.367 . . . . 0.0 112.428 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.545 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.7 OUTLIER -110.36 157.59 19.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.393 179.435 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -148.84 173.01 28.89 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.5 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 26.1 t-80 -99.29 110.53 23.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.529 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 1.5 p -76.92 134.6 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.729 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 8.6 tt0 -90.63 150.99 43.45 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.239 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.729 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.5 -21.82 19.78 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.861 2.374 . . . . 0.0 113.033 -178.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.629 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.64 -9.75 42.71 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.337 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -89.64 171.49 9.64 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.607 0.241 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.896 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.9 t70 -87.84 160.98 17.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.046 0.45 . . . . 0.0 110.651 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.553 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 16.7 m-20 -71.52 -58.99 3.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.146 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD11 ' CD2' ' A' ' 99' ' ' TRP . 23.0 tp -65.97 -42.13 90.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.211 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.896 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.82 -42.54 47.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.7 0.286 . . . . 0.0 110.503 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.529 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 98.5 m -60.48 -44.08 96.3 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.35 67.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.879 178.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 89.8 mt -71.83 -51.98 19.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.354 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -60.61 -42.35 96.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.593 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.178 0.513 . . . . 0.0 109.779 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.57 HG22 ' CD1' ' A' ' 15' ' ' ILE . 66.5 m -59.14 -53.64 56.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.301 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.523 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.7 pt20 -72.6 -20.94 61.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.028 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -77.96 -40.25 39.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.841 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.683 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 59.1 mm-40 -111.34 12.8 21.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.346 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.54 -11.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.591 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.05 2.41 46.86 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.291 -0.957 . . . . 0.0 113.123 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.602 ' CG2' HD22 ' A' ' 75' ' ' LEU . 1.5 mt -105.47 129.65 58.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.815 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.8 pm0 -110.17 172.38 6.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.648 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.502 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.27 -36.26 20.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.15 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.68 -18.96 72.65 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.062 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.501 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 4.7 mt-30 -100.76 -5.02 26.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.546 0.213 . . . . 0.0 111.28 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.733 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -132.75 -170.15 2.39 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.417 177.943 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -133.54 100.37 4.78 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.049 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.521 HD11 HD21 ' A' ' 61' ' ' LEU . 17.7 mm -74.39 123.38 29.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.242 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.582 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -83.32 139.06 18.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -97.88 144.98 26.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.173 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.2 -23.52 31.72 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.884 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.536 ' CD1' HD22 ' A' ' 100' ' ' LEU . 11.0 t80 -103.44 128.55 50.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.155 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.488 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -157.98 130.98 7.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.265 179.485 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -151.99 137.27 17.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.913 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.745 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.2 OUTLIER -120.52 134.07 55.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.134 0.492 . . . . 0.0 112.04 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.702 HD11 ' HE2' ' A' ' 98' ' ' TYR . 7.9 mt -96.32 121.19 37.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -111.68 123.71 50.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.56 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 27.1 p90 -166.95 141.58 3.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.037 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.646 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.5 p -83.6 112.69 21.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.689 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.7 -97.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.674 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -74.05 -36.29 64.36 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.777 0.322 . . . . 0.0 110.943 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.7 t-20 178.98 24.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.218 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.567 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.6 tptt -155.32 126.95 3.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 110.891 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.619 ' HG2' ' HB1' ' A' ' 7' ' ' ALA . 56.3 Cg_endo -69.5 119.89 6.79 Favored 'Trans proline' 0 CA--C 1.515 -0.438 0 C-N-CA 123.437 2.758 . . . . 0.0 112.876 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.702 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 6.9 mmmt -101.51 129.39 47.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.04 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.2 m -95.49 114.62 26.4 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.745 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.4 t -113.75 107.76 23.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.653 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.37 120.33 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.702 ' HE2' HD11 ' A' ' 85' ' ' LEU . 8.5 m-85 -104.17 128.53 51.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.042 0.448 . . . . 0.0 111.705 -178.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CD2' HD11 ' A' ' 57' ' ' LEU . 7.9 m-90 -114.4 152.8 30.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.437 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.536 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 1.1 mt -88.59 121.37 30.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.509 ' HB3' HD21 ' A' ' 13' ' ' LEU . . . -130.8 144.71 51.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.549 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.9 tt0 -122.83 113.85 19.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.387 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.733 HG13 HD23 ' A' ' 75' ' ' LEU . 17.4 m -72.78 115.45 13.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 121.399 0.619 . . . . 0.0 110.869 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -60.24 -26.74 66.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.662 -178.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.886 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 2.1 m-20 -93.8 110.1 21.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.19 0.519 . . . . 0.0 111.501 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -58.38 -38.49 77.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.09 26.13 9.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.807 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.886 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.9 p -47.85 149.45 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.419 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.4 ' HE2' HE22 ' A' ' 74' ' ' GLN . 3.7 pm0 -73.39 142.31 46.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.134 0.493 . . . . 0.0 110.786 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.692 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.9 mm -118.27 99.65 8.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.591 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.1 OUTLIER -103.2 97.96 7.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.127 -179.457 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.464 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 5.5 mt -84.71 -177.75 6.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.775 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.44 -166.14 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.677 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -68.58 -14.99 63.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.685 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.61 23.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.687 0.279 . . . . 0.0 111.405 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.5 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 84.0 m-70 -119.76 122.08 40.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.899 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.507 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 3.3 pt20 -103.75 -7.67 20.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.601 -179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -165.7 154.78 11.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.047 0.451 . . . . 0.0 111.24 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.692 ' CE2' HG13 ' A' ' 110' ' ' ILE . 43.6 p90 -134.45 171.61 14.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.493 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -157.78 157.82 34.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.211 0.529 . . . . 0.0 111.506 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.564 ' C ' ' HG2' ' A' ' 30' ' ' GLU . 73.3 m95 -122.47 109.55 14.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.521 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.61 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -138.94 170.67 15.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.007 0.432 . . . . 0.0 111.458 -178.651 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -75.43 -155.13 4.95 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.075 179.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.427 HD23 ' HA ' ' A' ' 141' ' ' GLN . 7.2 tp -75.17 -41.23 58.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.652 0.263 . . . . 0.0 111.084 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -62.3 -51.24 68.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.37 -45.54 65.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.0 0.428 . . . . 0.0 110.479 -179.525 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -57.73 -29.98 65.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.238 0.542 . . . . 0.0 109.692 178.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 4.2 m -83.91 -32.1 25.3 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.32 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.586 ' NE2' ' HG ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -64.59 -44.27 91.16 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.68 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -77.13 -43.98 32.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.923 179.119 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.27 53.61 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.425 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.91 -30.57 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.571 -179.203 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.513 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 12.1 m-85 -60.28 118.49 6.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.426 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.447 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 8.7 tttt -46.4 -46.62 18.69 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.237 0.541 . . . . 0.0 111.693 -179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.544 ' HB3' ' CD1' ' A' ' 85' ' ' LEU . 14.9 mp0 -50.84 -54.46 23.58 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.981 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.489 ' HE2' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.19 -42.62 99.46 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.136 -179.55 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.447 ' HZ2' ' HA ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -51.76 -34.7 40.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 110.148 179.547 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.518 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.75 -47.45 25.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.939 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.419 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.94 -41.73 62.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.088 0.47 . . . . 0.0 110.207 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.69 -28.18 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.08 178.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.518 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.36 -52.02 51.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.05 -32.77 69.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.483 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.454 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.07 -39.78 90.29 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.215 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.4 -31.25 37.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.863 0.363 . . . . 0.0 110.588 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.54 -52.55 57.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.366 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.01 -53.55 48.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.927 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.582 ' CD2' HG12 ' A' ' 78' ' ' ILE . 86.8 mt -55.35 -39.79 70.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.921 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.5 t -60.75 -15.64 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.713 0.292 . . . . 0.0 110.888 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.63 -14.9 27.51 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.45 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.517 HD12 HD21 ' A' ' 147' ' ' LEU . 2.1 mt -81.69 -129.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.793 -0.185 . . . . 0.0 110.544 -179.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -90.55 3.19 54.73 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.41 60.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.586 0.231 . . . . 0.0 111.417 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.959 179.794 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.56 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.774 ' O ' HD21 ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.539 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 131.06 17.08 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 124.338 3.359 . . . . 0.0 109.619 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.774 HD21 ' O ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -159.91 98.83 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.89 0.376 . . . . 0.0 111.067 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.54 134.75 1.73 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.541 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.3 t -67.45 139.31 57.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.892 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 10.5 tpt -75.82 123.14 25.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.0 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.671 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 70.02 164.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.646 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.611 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -107.75 130.4 54.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.602 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.07 111.95 19.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.864 179.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.55 ' HB2' ' HG3' ' A' ' 94' ' ' LYS . . . -124.71 173.45 8.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.887 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.495 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 6.5 m -161.73 124.06 2.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.14 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.454 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -115.06 170.67 13.34 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.509 HD23 ' HB2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -122.72 117.95 26.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.478 0.639 . . . . 0.0 111.687 -179.438 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.662 HG13 ' HB3' ' A' ' 98' ' ' TYR . 65.1 mt -82.24 91.17 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.638 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 177.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.639 HD12 HD23 ' A' ' 32' ' ' LEU . 19.6 mt -79.57 143.23 12.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.833 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.716 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 32.7 p90 -148.5 122.26 9.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.277 -178.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.587 ' HG2' HG21 ' A' ' 103' ' ' VAL . 63.2 mtm180 -80.79 114.2 19.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.402 ' NH1' ' HB1' ' A' ' 152' ' ' ALA . 15.9 ttm180 -82.46 113.47 20.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.81 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.5 p -72.36 160.62 32.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.544 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.6 mt -59.72 -80.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.547 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.47 HD12 HG21 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -125.91 148.11 61.45 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -60.69 156.46 42.56 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.577 2.185 . . . . 0.0 112.344 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -77.97 0.52 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.805 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.456 HG22 ' N ' ' A' ' 25' ' ' ASP . 17.3 m -133.47 -37.55 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.327 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.456 ' N ' HG22 ' A' ' 24' ' ' VAL . 0.2 OUTLIER 164.61 25.41 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.695 179.826 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -60.22 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.897 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -149.71 -29.78 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.806 0.336 . . . . 0.0 110.608 179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 70.07 -61.91 0.44 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.741 179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.716 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.3 mt -102.27 151.13 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.411 0.624 . . . . 0.0 112.377 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.637 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 41.8 mt-10 -135.33 139.69 44.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.422 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.595 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.9 m-85 -101.36 152.42 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.639 HD23 HD12 ' A' ' 15' ' ' ILE . 23.6 tp -85.17 138.59 32.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.931 179.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.616 HD21 ' HB3' ' A' ' 43' ' ' TRP . 7.3 mt -138.37 136.22 36.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.502 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.633 HD11 ' O ' ' A' ' 67' ' ' GLU . 13.6 mt -113.84 113.04 24.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.635 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 6.2 tp60 -66.12 126.6 29.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 110.868 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.56 127.14 30.04 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.9 p -73.13 4.58 4.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.484 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -174.42 172.48 3.16 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-O 120.804 0.335 . . . . 0.0 110.433 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.36 -123.27 7.85 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.353 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.54 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.3 pt -99.24 9.46 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.498 0.19 . . . . 0.0 111.355 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.8 m-70 62.85 41.05 9.1 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.418 0.628 . . . . 0.0 109.483 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.54 ' HB3' HD11 ' A' ' 40' ' ' ILE . 6.9 p-80 -88.21 163.43 16.14 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.233 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.635 ' CH2' ' HB2' ' A' ' 35' ' ' GLN . 77.0 m95 -112.81 120.31 41.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.532 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.599 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.9 OUTLIER -145.32 130.91 9.39 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -58.49 175.95 0.48 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.075 1.85 . . . . 0.0 111.594 179.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.705 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.8 Cg_exo -57.78 105.02 0.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.501 2.134 . . . . 0.0 112.78 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.599 ' HE3' ' HB ' ' A' ' 44' ' ' THR . 8.9 mtmp? -101.22 144.73 29.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.704 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -122.82 -162.67 11.6 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.564 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.54 96.0 3.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.94 0.4 . . . . 0.0 110.642 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.602 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 2.1 p -77.88 132.85 31.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.828 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.563 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -96.98 179.17 1.16 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.107 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.563 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.1 Cg_exo -57.01 -59.06 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.145 1.897 . . . . 0.0 112.593 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.65 2.29 87.55 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.47 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.456 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 9.7 tt0 -80.21 174.01 12.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.789 0.328 . . . . 0.0 110.6 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.846 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.7 t70 -94.39 153.77 17.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.216 0.532 . . . . 0.0 110.432 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.587 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -72.14 -63.37 1.15 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.286 -179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.543 ' HG ' HD11 ' A' ' 61' ' ' LEU . 20.7 tp -63.97 -39.54 94.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.618 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.846 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.76 -49.93 56.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.666 0.27 . . . . 0.0 110.745 -179.782 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.495 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 55.5 m -54.03 -40.8 67.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.73 61.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 178.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.647 HD23 HD12 ' A' ' 77' ' ' ILE . 90.1 mt -74.94 -53.49 8.91 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.75 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -59.81 -38.22 81.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.419 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.89 -36.11 82.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.023 0.44 . . . . 0.0 109.962 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.705 ' HA ' ' CB ' ' A' ' 46' ' ' PRO . 14.0 m -60.13 -55.91 28.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.597 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.556 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -70.16 -22.11 63.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.868 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -79.06 -40.19 31.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.897 0.38 . . . . 0.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.633 ' O ' HD11 ' A' ' 34' ' ' LEU . 96.1 mt-10 -109.91 11.24 24.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.44 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -155.47 -6.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.51 0.31 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.819 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.556 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 2.7 mt -103.06 121.14 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 117.049 0.425 . . . . 0.0 110.48 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.541 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.4 pt-20 -108.66 173.27 6.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.082 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.553 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.97 -37.58 32.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.381 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.36 -16.14 73.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.153 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.837 HE21 ' HE2' ' A' ' 109' ' ' GLU . 1.6 tp60 -102.49 -4.41 25.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.524 0.202 . . . . 0.0 111.261 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.64 HD21 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -134.39 -174.07 3.46 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.857 0.36 . . . . 0.0 110.219 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.496 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 51.4 m -130.48 100.96 5.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.29 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.704 HD11 ' HB3' ' A' ' 101' ' ' ALA . 14.7 mm -74.1 129.34 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.397 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.505 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -92.27 139.58 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.528 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -98.74 151.41 20.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.0 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -26.42 24.15 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.453 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.583 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 11.1 t80 -104.3 127.35 51.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.017 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.46 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.4 ttpt -158.12 125.7 5.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.154 0.502 . . . . 0.0 111.662 179.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 139.91 25.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.551 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.707 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.7 OUTLIER -120.96 132.84 55.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.921 0.391 . . . . 0.0 111.429 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.491 HD13 ' C ' ' A' ' 135' ' ' GLU . 7.8 mt -98.25 116.93 31.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.615 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.5 m-80 -107.22 125.38 51.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.378 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.574 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 27.5 p90 -167.37 143.18 4.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.092 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.55 ' O ' HG13 ' A' ' 88' ' ' VAL . 8.3 p -83.66 106.45 14.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.626 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.48 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -79.23 -101.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.837 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 6.0 ptt180 -57.16 -41.41 79.15 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 6.6 p-10 172.55 29.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.376 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.611 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -157.73 128.96 3.75 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.292 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.671 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 40.8 Cg_endo -66.86 121.33 8.52 Favored 'Trans proline' 0 CA--C 1.514 -0.48 0 C-N-CA 123.287 2.658 . . . . 0.0 112.525 -179.415 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.55 ' HG3' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -104.92 123.65 48.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.895 -178.63 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 97.4 m -91.24 106.31 18.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.707 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.6 t -108.5 108.46 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.657 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.58 127.54 40.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.662 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.0 m-85 -115.35 130.0 56.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.587 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 15.0 m-90 -111.09 169.65 8.63 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.134 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.493 HD11 ' HG ' ' A' ' 147' ' ' LEU . 1.1 mt -102.95 112.32 25.09 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.704 ' HB3' HD11 ' A' ' 77' ' ' ILE . . . -121.34 151.2 40.38 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.53 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tt0 -125.88 112.24 15.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.414 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.64 HG12 HD21 ' A' ' 75' ' ' LEU . 5.0 m -72.07 112.92 8.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.548 0.69 . . . . 0.0 110.79 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.501 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 2.0 ptpt -58.01 -27.16 63.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.225 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.845 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 16.2 m-20 -94.32 111.06 22.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.203 0.525 . . . . 0.0 111.593 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.454 ' CE1' ' NH1' ' A' ' 17' ' ' ARG . 17.0 t80 -57.67 -39.99 78.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.422 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -103.86 27.34 7.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.715 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.845 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -46.9 151.53 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.749 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.837 ' HE2' HE21 ' A' ' 74' ' ' GLN . 0.2 OUTLIER -76.8 144.75 38.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.294 0.568 . . . . 0.0 111.231 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.652 ' CG2' HD23 ' A' ' 112' ' ' LEU . 44.9 mm -121.63 99.3 6.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.967 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.661 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -98.77 101.83 13.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.926 -178.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.652 HD23 ' CG2' ' A' ' 110' ' ' ILE . 14.4 mt -95.94 140.41 30.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.73 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.7 p -83.08 -164.94 0.95 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.414 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -72.86 -4.53 32.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.501 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -91.47 -22.89 20.18 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.603 0.239 . . . . 0.0 111.426 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 94.2 m-70 -120.84 129.36 53.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.017 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -98.74 -12.53 20.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.573 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.39 173.73 6.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.418 . . . . 0.0 111.436 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.587 ' CE2' HG13 ' A' ' 110' ' ' ILE . 46.8 p90 -146.68 174.64 11.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.578 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.472 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 49.7 mtt180 -156.12 153.6 29.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 111.745 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.55 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 95.2 m95 -119.02 107.67 13.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.276 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.532 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -138.2 167.42 21.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 111.51 -178.654 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.67 -152.6 3.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.1 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 141' ' ' GLN . 8.4 tp -77.25 -43.42 33.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.684 0.278 . . . . 0.0 111.292 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.2 pt-20 -59.91 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.665 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.851 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.28 -43.76 60.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.055 -179.434 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.36 -29.82 67.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.361 0.601 . . . . 0.0 109.747 179.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.7 m -84.84 -33.71 22.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.49 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.851 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.67 -43.51 84.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.559 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.581 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -75.27 -45.73 38.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.43 54.44 2.04 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.105 0.479 . . . . 0.0 109.865 178.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.0 -33.59 0.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.566 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.519 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 4.4 m-85 -54.2 119.52 5.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.108 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -45.98 -47.72 16.61 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.302 0.572 . . . . 0.0 111.354 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.519 ' OE2' ' HB3' ' A' ' 133' ' ' PHE . 26.0 mp0 -49.66 -57.14 7.77 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.911 -179.261 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.438 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.14 -46.86 87.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.398 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.02 -41.36 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.169 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.496 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.97 -47.38 65.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.411 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.573 ' CB ' HD11 ' A' ' 14' ' ' ILE . . . -52.15 -41.98 63.01 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.38 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.65 -28.19 33.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.119 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.63 -52.56 43.76 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.22 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.583 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -74.47 -25.37 59.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 -179.769 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.517 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.53 -47.64 88.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.472 -0.871 . . . . 0.0 111.771 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.411 ' CD2' HD12 ' A' ' 29' ' ' ILE . 5.9 t-160 -76.08 -29.67 58.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.962 0.41 . . . . 0.0 110.655 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -68.95 -52.81 25.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.471 ' CE1' HD12 ' A' ' 150' ' ' ILE . 19.3 t80 -61.52 -47.57 85.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.856 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.64 HD12 ' CE2' ' A' ' 16' ' ' PHE . 65.0 mt -54.29 -44.48 71.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.593 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.6 -11.99 59.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.926 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.16 -13.69 26.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.439 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.481 ' CD1' HD22 ' A' ' 147' ' ' LEU . 1.5 mt -80.49 -130.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.609 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.42 ' O ' HD12 ' A' ' 153' ' ' LEU . 0.6 OUTLIER -95.28 -67.23 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 111.17 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . 0.402 ' HB1' ' NH1' ' A' ' 18' ' ' ARG . . . -67.37 142.09 56.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.485 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.42 HD12 ' O ' ' A' ' 151' ' ' GLU . 5.9 mp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.835 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.574 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.569 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.483 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.36 -33.32 9.12 Favored 'Trans proline' 0 N--CA 1.448 -1.194 0 C-N-CA 124.354 3.369 . . . . 0.0 109.575 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.3 tp 61.97 91.85 0.06 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.349 . . . . 0.0 110.76 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.72 -40.91 3.73 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.54 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -81.18 109.84 16.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.682 0.277 . . . . 0.0 110.983 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.6 tpt -178.56 155.61 0.85 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.943 0.402 . . . . 0.0 111.015 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.633 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 66.4 169.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.362 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.654 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -111.09 138.66 47.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.01 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.563 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -84.25 112.84 20.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.578 179.432 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -124.71 170.73 10.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.258 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 3.9 m -163.16 124.48 2.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.087 0.47 . . . . 0.0 111.115 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.425 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.52 177.61 16.5 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.583 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.475 HD22 ' HB2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -131.2 118.12 19.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.028 0.414 . . . . 0.0 111.762 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.714 HG13 ' HB3' ' A' ' 98' ' ' TYR . 65.4 mt -82.73 92.08 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.613 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 32.7 mt -83.73 145.16 8.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.444 -177.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.731 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.2 122.47 7.21 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.284 -179.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.615 ' HG2' HG23 ' A' ' 103' ' ' VAL . 0.7 OUTLIER -80.65 112.94 18.49 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.124 179.19 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -95.6 105.41 17.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.436 -179.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.39 160.81 18.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.714 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.51 -78.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.8 pp -119.21 157.1 51.91 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.737 179.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.83 143.89 69.05 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.439 2.092 . . . . 0.0 112.414 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -104.17 -81.87 0.51 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.065 -179.889 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 6.1 t -103.4 6.3 10.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.758 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 64.96 34.32 9.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.839 0.352 . . . . 0.0 110.989 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -102.94 -58.33 1.89 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 110.505 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -154.25 105.37 2.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.567 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.58 -33.69 58.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.35 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.731 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -115.12 146.44 19.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.239 0.542 . . . . 0.0 112.149 -179.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 20.5 mt-10 -136.35 129.68 31.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.926 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.613 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 63.7 m-85 -91.64 150.01 21.36 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.509 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 55.1 tp -84.82 133.73 34.32 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.506 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -134.98 141.18 46.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.639 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.412 ' HB2' ' CD2' ' A' ' 116' ' ' HIS . 14.4 mt -119.09 121.47 39.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.184 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.49 ' HG2' ' H ' ' A' ' 37' ' ' SER . 39.4 tt0 -61.42 162.48 7.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.59 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.419 ' O ' ' OG ' ' A' ' 37' ' ' SER . . . -90.73 -10.98 40.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.795 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.495 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 8.2 p 73.8 -59.4 0.56 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.77 0.319 . . . . 0.0 110.93 -179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -117.54 171.41 8.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.41 -125.65 7.44 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.519 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.492 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.7 tt -88.87 -2.68 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.3 m80 60.73 33.19 20.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.97 0.414 . . . . 0.0 110.519 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 -61.6 140.56 58.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.657 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.692 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 40.8 m95 -101.66 119.79 39.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -139.59 141.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.797 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.94 166.48 2.99 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.516 2.144 . . . . 0.0 112.09 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.727 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 24.3 Cg_exo -63.33 82.67 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.751 2.301 . . . . 0.0 112.132 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.425 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 12.8 pttm -87.05 156.22 19.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.085 0.469 . . . . 0.0 111.335 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.23 -178.86 19.42 Favored Glycine 0 N--CA 1.45 -0.371 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.302 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.46 ' NE2' ' HB3' ' A' ' 8' ' ' LEU . 4.8 t-80 -108.49 118.69 37.43 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.563 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -93.06 134.79 29.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.256 0.55 . . . . 0.0 111.25 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.651 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 5.1 tt0 -93.52 152.06 40.63 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.878 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.552 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.5 Cg_endo -54.23 -22.04 24.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.644 2.23 . . . . 0.0 112.58 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.651 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.07 -14.35 36.56 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.795 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' HB3' HG21 ' A' ' 50' ' ' VAL . 17.1 tt0 -83.06 168.15 17.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.66 0.267 . . . . 0.0 110.671 179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.983 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 27.4 t70 -85.69 161.65 19.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.114 0.483 . . . . 0.0 110.747 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.502 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -72.05 -63.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 -179.824 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.612 ' HG ' HD11 ' A' ' 61' ' ' LEU . 22.7 tp -66.66 -39.4 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.962 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.983 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.3 tt0 -49.69 -46.76 50.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.503 HG21 ' N ' ' A' ' 50' ' ' VAL . 96.9 m -58.85 -47.59 84.33 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' A' ' 64' ' ' THR . . . -65.75 -29.81 70.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.085 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.7 HD23 ' HB1' ' A' ' 72' ' ' ALA . 87.8 mt -72.18 -53.53 12.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.948 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -64.02 -33.05 74.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.567 -179.85 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.95 -32.15 72.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.028 0.442 . . . . 0.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.727 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 23.1 m -60.46 -51.17 70.61 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.499 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.519 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -75.54 -20.6 58.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.07 179.673 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.524 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.3 tm-20 -78.32 -38.28 42.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.056 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 96.3 mt-10 -110.25 -0.66 17.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.8 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.564 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -141.37 -10.9 0.94 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.616 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 75.26 -4.51 40.3 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.111 -1.042 . . . . 0.0 113.088 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.54 HG22 ' HG2' ' A' ' 74' ' ' GLN . 4.5 mt -100.71 126.95 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.085 0.469 . . . . 0.0 111.278 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.508 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.0 pt-20 -109.96 170.44 8.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.786 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.7 ' HB1' HD23 ' A' ' 61' ' ' LEU . . . -46.98 -38.89 11.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.039 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.95 -22.77 70.69 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.247 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.54 ' HG2' HG22 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -98.67 -1.9 39.63 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.476 0.179 . . . . 0.0 111.244 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.631 HD23 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -136.95 -169.63 2.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.201 178.148 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.57 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 24.4 m -136.34 99.68 4.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.609 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.414 HG23 ' CD2' ' A' ' 57' ' ' LEU . 8.4 mm -72.01 123.57 26.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.968 0.413 . . . . 0.0 111.009 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.509 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.87 139.23 17.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.777 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -98.75 151.7 20.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.097 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.1 -23.75 33.48 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.06 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.547 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 7.4 t80 -108.88 127.24 53.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.409 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -159.01 127.79 5.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.214 0.53 . . . . 0.0 111.645 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.444 HH12 ' HG2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -153.81 141.52 20.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.851 179.099 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.686 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.0 OUTLIER -121.86 132.53 54.62 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.178 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.483 ' HG ' ' CE1' ' A' ' 98' ' ' TYR . 10.7 mt -94.54 118.74 32.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.351 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -105.72 126.02 51.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 19.9 p90 -166.57 141.09 4.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.645 ' O ' HG11 ' A' ' 88' ' ' VAL . 7.2 p -80.72 113.33 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.878 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.448 ' HB3' " H4'" ' A' ' 154' ' ' ATP . . . -76.19 -107.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.369 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -61.65 -42.35 98.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.964 0.411 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -176.69 26.83 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.808 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.654 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.48 128.18 4.15 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.633 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 58.6 Cg_endo -72.22 116.0 4.54 Favored 'Trans proline' 0 CA--C 1.506 -0.895 0 C-N-CA 123.173 2.582 . . . . 0.0 112.404 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.638 ' HD3' ' CG2' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -105.93 122.2 45.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.791 -179.205 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.9 m -79.47 120.27 23.64 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 9.5 t -115.0 108.72 26.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.815 -178.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.602 HG23 ' CH2' ' A' ' 99' ' ' TRP . 1.2 mm -86.42 133.59 29.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.714 ' HB3' HG13 ' A' ' 14' ' ' ILE . 77.6 m-85 -118.11 129.85 55.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.107 0.48 . . . . 0.0 111.743 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.602 ' CH2' HG23 ' A' ' 97' ' ' ILE . 10.6 m-90 -117.47 139.57 50.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.934 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.479 HD21 ' CE1' ' A' ' 81' ' ' PHE . 1.1 mt -76.58 116.17 17.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.57 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -126.94 146.37 50.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 110.681 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.568 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.1 tm-20 -122.77 116.93 24.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.551 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.631 HG13 HD23 ' A' ' 75' ' ' LEU . 12.9 m -73.12 120.65 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.371 0.605 . . . . 0.0 110.422 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -28.96 69.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.121 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.761 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 51.4 t0 -98.72 128.21 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.064 0.459 . . . . 0.0 111.978 -179.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.56 -42.24 61.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.436 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.592 ' CG ' ' HD2' ' A' ' 105' ' ' ASP . 1.8 p30 -91.25 19.7 5.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.483 178.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.761 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.4 p -47.69 143.58 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.927 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.48 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -66.35 142.55 57.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.468 0.652 . . . . 0.0 111.649 -178.994 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.647 HG13 ' CE2' ' A' ' 119' ' ' TYR . 40.1 mm -123.96 95.36 3.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.953 179.129 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.616 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 12.3 mtp180 -95.22 101.34 13.07 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.727 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.709 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 12.2 mt -95.42 151.88 18.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.86 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.3 m -81.38 -169.03 2.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.109 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.25 6.12 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.535 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -102.23 -32.11 10.23 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.612 0.244 . . . . 0.0 111.149 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.709 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.3 m80 -97.16 113.47 25.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.974 0.416 . . . . 0.0 111.078 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.495 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 7.0 tp60 -76.19 -19.46 58.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.699 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.77 -177.12 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.0 111.94 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.647 ' CE2' HG13 ' A' ' 110' ' ' ILE . 36.3 p90 -151.01 162.73 40.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.992 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.692 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -150.67 141.64 22.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.266 0.555 . . . . 0.0 111.681 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.483 ' CH2' HG21 ' A' ' 103' ' ' VAL . 84.4 m95 -98.79 107.64 20.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.222 178.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.508 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -135.09 168.31 19.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.814 -177.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.446 ' O ' ' HB2' ' A' ' 127' ' ' ALA . . . -76.5 -152.02 4.17 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.599 179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 6.7 tp -77.0 -40.94 44.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.826 0.346 . . . . 0.0 111.044 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -61.0 -51.18 70.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.866 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.662 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.69 -32.97 66.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 0.0 110.703 -179.334 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.506 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -69.91 -29.69 66.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.357 0.599 . . . . 0.0 109.497 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.43 -31.36 24.66 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.429 178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.662 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.7 OUTLIER -66.64 -45.51 78.78 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.782 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.563 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.8 mt -74.09 -44.82 52.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.67 51.98 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.191 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.425 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.1 -28.35 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.67 -179.494 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.502 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -58.11 117.41 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.405 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.445 ' HA ' ' HZ1' ' A' ' 137' ' ' LYS . 1.2 tttm -46.06 -44.98 15.85 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 111.778 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.502 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 20.9 mp0 -53.47 -53.36 52.51 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.624 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.494 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.97 -49.64 75.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.746 0.308 . . . . 0.0 111.394 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.477 ' HB2' ' HZ1' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -48.65 -39.61 24.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.11 179.656 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.493 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.88 -46.45 57.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.069 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.577 ' HB1' HD13 ' A' ' 14' ' ' ILE . . . -53.7 -41.47 66.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.161 0.505 . . . . 0.0 109.972 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.47 -27.93 41.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.174 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.493 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.01 -52.6 40.51 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.568 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.547 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 2.4 mp0 -73.75 -25.48 60.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.572 -179.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.441 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -62.09 -43.12 99.59 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.378 -0.915 . . . . 0.0 111.108 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 4.8 t-80 -79.75 -31.92 41.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.027 0.442 . . . . 0.0 109.995 178.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 13.6 tp60 -65.53 -50.88 63.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.743 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.5 ' CE1' HD13 ' A' ' 150' ' ' ILE . 49.7 t80 -63.16 -50.51 70.11 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.732 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.543 HD11 ' CE1' ' A' ' 16' ' ' PHE . 97.8 mt -55.67 -30.6 61.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.98 -18.83 60.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.691 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.4 -9.86 40.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.422 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.531 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -86.17 -130.38 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.436 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -172.79 -68.22 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.937 0.398 . . . . 0.0 110.571 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 176.39 177.36 0.25 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.837 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.593 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.799 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.799 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 82.4 Cg_endo -72.45 29.43 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 124.298 3.332 . . . . 0.0 109.59 179.4 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.548 ' H ' ' C ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -59.87 125.69 24.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.709 0.29 . . . . 0.0 110.946 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -153.19 -120.72 0.82 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.573 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.9 p -59.51 129.17 40.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.557 0.218 . . . . 0.0 111.019 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.466 ' O ' ' HG3' ' A' ' 6' ' ' MET . 0.9 OUTLIER -62.36 100.8 0.19 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.853 0.359 . . . . 0.0 110.535 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.67 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 52.47 173.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.265 0.555 . . . . 0.0 110.993 -179.739 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.647 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -117.92 140.31 49.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.809 178.839 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.602 ' HB3' HG11 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -84.56 133.11 34.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.748 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -150.66 166.34 30.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.596 179.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.451 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 96.4 m -155.25 124.59 6.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.916 0.388 . . . . 0.0 111.515 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.597 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -112.06 172.59 14.89 Favored Glycine 0 N--CA 1.452 -0.292 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 178.736 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.528 HD21 ' HB2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -127.14 117.76 23.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.294 0.547 . . . . 0.0 111.487 -179.931 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.589 HG13 ' HB3' ' A' ' 98' ' ' TYR . 74.3 mt -84.03 91.53 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.038 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 10.3 mt -83.11 146.2 7.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.172 -178.501 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.742 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.6 p90 -151.82 122.95 7.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.961 -178.755 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.518 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.83 111.64 17.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.949 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.64 108.51 18.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.74 151.54 21.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.867 -179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.516 ' HG ' ' N ' ' A' ' 21' ' ' ILE . 1.3 pt? -57.45 -45.61 84.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.0 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.516 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 1.3 pp -173.7 155.16 2.49 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.716 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.404 ' HB3' ' O ' ' A' ' 26' ' ' ASN . 18.1 Cg_exo -66.95 149.01 82.94 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.644 2.23 . . . . 0.0 112.39 179.828 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.576 ' HB2' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -103.35 -80.79 0.52 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.422 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.7 m -134.86 -39.7 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.778 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -135.81 45.83 2.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.561 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.576 HD22 ' HB2' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -161.32 117.24 2.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.116 179.492 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -67.84 -170.45 0.16 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.723 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.9 -72.58 0.24 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.417 -179.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.742 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 11.2 mt -99.58 147.83 6.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.376 0.607 . . . . 0.0 111.866 -179.17 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.532 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.7 mt-10 -136.74 122.94 20.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.306 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.6 m-85 -87.39 141.91 28.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.934 -178.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.546 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 38.3 tp -79.97 133.61 36.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.435 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -136.65 137.0 39.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.538 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 12.6 mt -113.8 125.9 54.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.985 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.553 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 2.1 tt0 -57.82 168.61 0.88 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.394 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.71 -26.04 22.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.126 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.71 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 2.8 p 78.77 -15.87 0.72 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.868 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -158.63 -169.1 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.22 20.6 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.614 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.498 ' O ' HG12 ' A' ' 40' ' ' ILE . 11.9 tt -91.08 -1.91 10.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.635 0.255 . . . . 0.0 111.358 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 63.56 26.41 14.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.477 ' HB3' HG23 ' A' ' 40' ' ' ILE . 29.9 p-80 -60.52 159.38 10.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.842 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.553 ' CE2' ' HG3' ' A' ' 35' ' ' GLN . 50.6 m95 -111.7 135.6 52.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.021 -179.915 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.6 p -160.95 147.72 11.79 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.671 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.415 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 23.8 Cg_endo -61.36 169.44 6.51 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.574 2.183 . . . . 0.0 112.202 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.46 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 63.6 Cg_endo -75.54 108.59 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.798 2.332 . . . . 0.0 112.388 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.597 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.0 pttp -106.36 141.15 38.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 111.295 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -110.83 -161.74 17.77 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.964 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -130.04 105.12 7.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.602 HG11 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -78.22 113.93 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 121.295 0.569 . . . . 0.0 110.976 -179.783 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.639 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -74.52 177.99 1.93 Allowed Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.578 -179.919 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.639 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.3 Cg_exo -56.84 -50.04 12.76 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.338 2.026 . . . . 0.0 112.771 -179.518 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -96.06 12.88 66.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.908 -179.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.491 ' HB3' HG22 ' A' ' 50' ' ' VAL . 35.2 tt0 -86.5 167.29 14.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 -179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.966 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.3 t70 -92.21 158.71 16.0 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.18 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.434 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 2.9 m-20 -73.08 -61.46 1.81 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.304 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.646 HD12 ' CD2' ' A' ' 99' ' ' TRP . 17.9 tp -63.2 -39.78 95.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 0.0 110.935 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.966 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.84 -50.78 44.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 110.862 -179.897 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.451 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 56.3 m -55.63 -41.49 73.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.423 ' HB3' ' O ' ' A' ' 12' ' ' GLY . . . -72.25 -30.32 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.996 178.357 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 95.9 mt -72.76 -52.25 15.81 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.272 179.133 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.441 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.58 -40.65 95.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.811 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.31 -36.5 78.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.562 HG22 ' CD1' ' A' ' 15' ' ' ILE . 85.5 m -59.78 -58.07 10.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.855 179.299 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.544 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.7 pt20 -68.91 -21.8 64.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 22.5 mt-10 -79.03 -42.87 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.358 . . . . 0.0 110.958 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -103.79 1.78 32.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.742 -179.623 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -144.54 -5.87 0.73 Allowed 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -179.804 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 65' ' ' GLN . . . 68.7 -1.59 9.61 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.141 -1.028 . . . . 0.0 112.811 -179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.544 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.6 mt -103.06 125.07 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.308 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -111.38 173.55 6.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.741 -179.619 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.481 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -49.42 -38.27 28.54 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.629 179.402 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.71 -14.46 60.57 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.449 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -106.98 -15.44 14.7 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.821 0.311 . . . . 0.0 111.453 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.721 HD22 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -123.65 -175.13 3.14 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.939 0.399 . . . . 0.0 110.449 178.623 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.525 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 43.0 m -129.27 100.76 5.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.094 -179.58 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.411 HD11 HD12 ' A' ' 13' ' ' LEU . 13.2 mm -72.82 115.09 13.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.762 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.464 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -75.91 136.01 25.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -93.76 151.61 19.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.338 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.24 -23.51 35.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.292 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.433 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.7 t80 -107.29 127.03 53.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.789 0.328 . . . . 0.0 111.174 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.455 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.6 ttpt -158.72 125.12 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 179.637 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.92 145.05 31.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.085 179.403 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.731 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -126.17 126.38 44.01 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.224 179.852 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.535 HD13 ' HE2' ' A' ' 98' ' ' TYR . 4.7 mt -90.68 120.06 31.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 1.9 m-80 -110.47 124.22 51.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 -179.499 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.627 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 18.3 p90 -166.87 137.85 3.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.966 0.412 . . . . 0.0 111.126 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.604 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.8 p -76.33 113.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.345 0.593 . . . . 0.0 110.889 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.536 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -79.82 -105.56 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.819 -178.72 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 1.6 ptt-85 -63.45 -35.92 82.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.978 0.418 . . . . 0.0 110.394 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.449 ' HB2' ' O ' ' A' ' 90' ' ' ARG . 9.6 t-20 176.28 27.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.969 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.497 ' HB3' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.27 128.04 3.87 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 0.0 110.981 -179.968 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.67 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 44.0 Cg_endo -70.18 118.69 5.83 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.422 2.748 . . . . 0.0 113.099 -179.226 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.647 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 6.2 mmmt -99.26 130.2 45.54 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.144 -179.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.8 m -95.6 107.16 19.33 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.731 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 44.8 t -107.13 108.0 24.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.789 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.5 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.13 128.71 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.519 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.589 ' HB3' HG13 ' A' ' 14' ' ' ILE . 10.6 m-85 -108.54 163.25 13.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.334 0.588 . . . . 0.0 111.439 -178.83 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CD2' HD12 ' A' ' 57' ' ' LEU . 2.8 m-90 -150.75 136.23 17.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.172 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.5 HD12 ' HG ' ' A' ' 147' ' ' LEU . 0.4 OUTLIER -76.97 114.6 15.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.11 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.539 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -125.86 151.46 46.82 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 120.749 0.309 . . . . 0.0 111.305 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.3 OUTLIER -124.86 113.35 17.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.163 -179.598 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.721 HG12 HD22 ' A' ' 75' ' ' LEU . 10.5 m -71.92 122.83 25.06 Favored 'Isoleucine or valine' 0 C--N 1.338 0.07 0 CA-C-O 121.171 0.51 . . . . 0.0 110.323 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.1 mttt -65.26 -21.55 66.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.98 -178.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.797 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 5.9 m-20 -102.67 113.15 26.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.221 0.534 . . . . 0.0 111.624 -179.048 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -58.56 -38.33 77.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.237 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -103.24 23.3 12.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.548 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.797 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.1 p -42.99 148.83 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.826 -179.529 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.652 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 15.5 pm0 -73.22 141.76 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.273 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.681 HG22 ' CD1' ' A' ' 119' ' ' TYR . 36.6 mm -120.43 105.19 16.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.634 179.086 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.652 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -103.38 97.44 7.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.59 -179.241 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.431 HD21 HG21 ' A' ' 110' ' ' ILE . 3.3 mt -95.75 144.46 26.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.357 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.457 ' C ' ' H ' ' A' ' 115' ' ' GLU . 2.7 p -94.06 -169.36 2.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.606 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . 0.407 ' H ' ' CD2' ' A' ' 114' ' ' HIS . 4.4 p80 -67.55 10.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.689 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.4 mt-10 -100.88 -30.48 11.65 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.72 0.295 . . . . 0.0 110.887 179.431 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 26.1 m-70 -124.78 124.0 41.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.889 0.376 . . . . 0.0 110.942 -179.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.71 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -82.47 -17.57 44.77 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.5 -179.932 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -163.46 -176.56 4.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.241 0.544 . . . . 0.0 111.507 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.681 ' CD1' HG22 ' A' ' 110' ' ' ILE . 31.9 p90 -153.59 172.38 17.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.325 -179.589 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -157.9 157.87 33.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.118 0.485 . . . . 0.0 111.03 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.546 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 83.5 m95 -122.31 107.06 11.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.382 178.823 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.43 ' CD1' ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -135.82 165.09 26.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 0.0 111.567 -178.402 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.53 -154.14 1.21 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.819 179.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.8 tp -76.73 -43.67 36.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.836 0.35 . . . . 0.0 110.745 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -57.36 -51.63 68.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.614 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.551 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.62 -53.08 20.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.811 0.338 . . . . 0.0 110.244 -179.887 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.435 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.04 -27.41 7.93 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.525 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.415 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.5 OUTLIER -82.69 -35.25 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.511 178.392 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.594 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -63.55 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.5 -179.642 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.594 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -77.91 -39.77 41.87 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.265 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.407 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -80.03 47.8 0.92 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 179.285 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.19 -29.34 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.726 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.445 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -59.69 119.83 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.421 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -46.46 -46.24 18.77 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.218 0.532 . . . . 0.0 111.847 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.465 ' CD ' HN62 ' A' ' 154' ' ' ATP . 23.1 mp0 -52.7 -56.39 15.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.893 -178.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.471 ' HE2' ' CE2' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -59.43 -41.0 88.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.571 0.224 . . . . 0.0 111.446 -179.347 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.59 -42.3 64.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.103 179.455 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.11 -47.62 67.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.608 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.495 ' CB ' HD12 ' A' ' 14' ' ' ILE . . . -51.34 -49.1 62.07 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.92 0.391 . . . . 0.0 110.206 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.36 -26.81 60.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.319 178.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.539 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.06 -52.72 32.07 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.095 -179.818 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -68.79 -29.17 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.264 179.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.438 ' HA2' HD11 ' A' ' 100' ' ' LEU . . . -58.71 -48.46 84.83 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.854 179.379 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.444 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -74.55 -28.95 61.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.887 0.375 . . . . 0.0 110.743 179.579 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . 0.404 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 8.1 tp60 -68.35 -51.46 44.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.481 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.564 ' CD2' HD11 ' A' ' 150' ' ' ILE . 71.0 t80 -65.43 -51.21 61.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.996 0.427 . . . . 0.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.5 ' HG ' HD12 ' A' ' 100' ' ' LEU . 93.9 mt -56.33 -32.29 64.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.899 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 4.2 t -75.98 -14.03 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.0 110.714 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.41 -9.66 23.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.784 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 146' ' ' PHE . 0.9 OUTLIER -83.4 -132.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.611 -179.99 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.408 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 7.9 tm-20 -147.94 -69.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.881 0.372 . . . . 0.0 110.135 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -155.24 -77.45 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 179.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.745 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.627 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.571 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.259 -1.136 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.571 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.34 12.78 0.6 Allowed 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 124.288 3.325 . . . . 0.0 109.629 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.496 ' H ' ' C ' ' A' ' 1' ' ' GLY . 0.1 OUTLIER 61.15 90.27 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.823 -179.916 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -126.66 -36.08 0.53 Allowed Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.736 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 m -59.45 98.47 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.848 0.356 . . . . 0.0 111.271 -179.664 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.533 ' HE3' ' HB1' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -88.28 132.33 34.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.254 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.534 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . . . 64.21 178.16 0.17 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 111.003 -179.887 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.723 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.18 131.26 56.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.354 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.529 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -82.89 132.39 35.16 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.673 -178.907 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.438 ' CB ' ' HE3' ' A' ' 94' ' ' LYS . . . -145.1 163.22 34.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.507 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.7 m -154.52 124.31 6.65 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.029 0.443 . . . . 0.0 111.732 -179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.26 171.49 13.87 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 178.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.548 HD13 ' CD1' ' A' ' 77' ' ' ILE . 0.9 OUTLIER -122.57 117.89 26.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.28 0.54 . . . . 0.0 112.44 -179.174 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.861 HD13 ' HB3' ' A' ' 139' ' ' ALA . 54.2 mt -80.73 92.12 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.781 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.287 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.672 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 27.2 mt -84.4 146.88 6.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.706 -178.035 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.765 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.6 p90 -153.88 121.15 5.76 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.288 -179.385 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.445 ' CG ' ' HB2' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -79.74 114.42 18.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.518 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.431 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.5 OUTLIER -102.89 126.71 50.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.127 -179.112 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.78 159.23 19.8 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.435 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.67 -85.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.659 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.8 pp -115.94 148.73 41.95 Favored Pre-proline 0 C--N 1.332 -0.174 0 CA-C-O 120.654 0.264 . . . . 0.0 110.9 179.458 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.62 153.23 73.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.543 2.162 . . . . 0.0 112.541 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -132.16 -73.44 0.52 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.336 179.964 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.514 HG11 ' O ' ' A' ' 24' ' ' VAL . 23.3 t -72.33 -7.0 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.395 -179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.25 21.05 12.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 0.0 110.885 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -88.78 -78.19 0.35 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -121.36 -167.01 1.44 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.185 179.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 -50.5 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.959 0.409 . . . . 0.0 111.19 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.765 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.7 mt -111.14 141.11 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.056 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.651 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.1 mt-10 -133.89 127.25 32.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.046 179.102 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.672 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -87.09 154.37 20.8 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.5 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.573 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 39.2 tp -90.73 135.01 33.99 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.843 178.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.477 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.9 mt -135.11 142.02 46.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.757 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.521 HD12 ' N ' ' A' ' 46' ' ' PRO . 14.5 mt -121.81 107.42 12.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.419 ' HB2' ' CD2' ' A' ' 43' ' ' TRP . 37.3 tt0 -67.71 141.77 56.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.04 157.37 25.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.191 179.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.524 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 78.8 p -90.16 2.85 54.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.61 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -174.07 177.42 2.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.835 0.35 . . . . 0.0 110.93 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.31 -131.92 10.78 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.121 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.474 HG22 ' HB3' ' A' ' 42' ' ' HIS . 12.1 tt -82.59 -2.69 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.892 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 61.61 27.67 17.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.474 ' HB3' HG22 ' A' ' 40' ' ' ILE . 21.1 p-80 -60.43 148.9 35.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.849 0.357 . . . . 0.0 110.549 179.638 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.604 ' CZ3' ' HB2' ' A' ' 120' ' ' ARG . 37.5 m95 -98.11 150.1 21.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.035 179.916 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -171.54 144.02 1.56 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.524 -179.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.446 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 32.8 Cg_exo -61.56 165.63 13.1 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.356 2.037 . . . . 0.0 112.171 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.521 ' N ' HD12 ' A' ' 34' ' ' LEU . 18.4 Cg_endo -61.12 102.07 0.2 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.484 2.123 . . . . 0.0 112.443 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -87.92 155.44 19.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.907 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -138.13 174.29 22.0 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.206 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -115.81 103.53 10.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.677 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.4 p -81.3 127.37 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.302 0.572 . . . . 0.0 111.363 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.607 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.0 tt0 -88.46 153.24 50.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.291 179.968 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 12.5 Cg_endo -55.57 -18.74 21.07 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.985 2.456 . . . . 0.0 112.585 -179.525 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.607 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -107.54 -6.67 32.99 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.926 179.213 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -88.75 176.48 7.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.891 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -92.7 161.41 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.029 0.442 . . . . 0.0 109.991 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.442 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 24.3 m-20 -73.7 -61.06 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.849 -179.099 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.646 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 36.6 tp -65.91 -40.01 91.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.74 0.305 . . . . 0.0 110.831 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.891 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.15 -47.15 54.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.79 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.459 HG22 ' N ' ' A' ' 50' ' ' VAL . 85.1 m -58.0 -43.6 86.72 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.94 -32.7 71.11 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.019 178.755 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.641 HD12 ' HG ' ' A' ' 57' ' ' LEU . 91.2 mt -71.11 -51.77 23.18 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.491 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.519 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.2 OUTLIER -61.78 -41.03 97.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.011 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.22 -34.78 77.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.163 0.506 . . . . 0.0 110.24 179.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.596 HG22 ' CD1' ' A' ' 15' ' ' ILE . 93.5 m -60.08 -51.39 69.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.434 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.0 pt20 -76.85 -21.81 54.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.515 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.519 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -78.27 -35.03 48.59 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.304 . . . . 0.0 110.73 179.193 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.592 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 2.0 mp0 -108.18 -14.24 14.75 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.476 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -129.5 -8.79 4.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.691 0.281 . . . . 0.0 111.632 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.906 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.54 -8.65 25.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.236 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.682 HG22 ' HG2' ' A' ' 74' ' ' GLN . 3.2 mt -94.22 123.4 46.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.012 -179.677 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pm0 -103.54 169.38 8.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.023 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.588 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -45.89 -39.13 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.364 179.719 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.95 -23.02 74.32 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.382 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.682 ' HG2' HG22 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -95.76 1.39 53.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.726 0.298 . . . . 0.0 111.324 -179.994 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.799 HD21 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -137.69 -166.41 1.95 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.692 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -140.57 98.52 3.43 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.568 HG22 HD21 ' A' ' 57' ' ' LEU . 9.4 mm -73.24 114.2 12.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.074 0.464 . . . . 0.0 111.778 -179.848 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.475 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -77.05 138.13 21.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.62 179.322 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -97.52 148.82 22.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.403 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.93 -24.64 27.7 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.12 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.651 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 12.1 t80 -104.35 127.43 52.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.836 0.35 . . . . 0.0 111.146 -179.842 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.509 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -158.94 128.19 5.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.261 0.553 . . . . 0.0 111.31 179.577 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.4 tpt85 -154.53 137.86 15.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.95 179.294 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.707 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.9 pm0 -120.83 136.13 54.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.169 0.509 . . . . 0.0 111.455 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 135' ' ' GLU . 7.6 mt -95.24 118.21 31.61 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.168 179.163 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -108.34 126.3 52.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.735 -179.261 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.588 ' CE2' ' C6 ' ' A' ' 154' ' ' ATP . 7.4 p90 -167.0 141.0 3.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 -179.633 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.701 HG13 ' O ' ' A' ' 88' ' ' VAL . 9.9 p -80.7 113.57 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.53 0.681 . . . . 0.0 110.64 179.294 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.575 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -68.61 -102.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.352 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.402 HH11 ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -77.48 -35.01 54.14 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 120.964 0.412 . . . . 0.0 110.312 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -172.89 16.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.603 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.585 ' HB3' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -148.6 126.38 5.76 Favored Pre-proline 0 N--CA 1.451 -0.384 0 CA-C-O 120.945 0.402 . . . . 0.0 111.365 -179.616 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.649 ' HA ' ' HA ' ' A' ' 88' ' ' VAL . 50.6 Cg_endo -69.06 118.71 5.84 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.615 2.877 . . . . 0.0 113.234 -179.52 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.723 ' HD2' ' HB2' ' A' ' 8' ' ' LEU . 4.6 mmmt -101.39 124.76 47.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.331 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -89.4 114.93 26.45 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.707 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 37.5 t -113.52 108.03 24.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.759 -178.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.545 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.35 132.5 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.707 ' HB3' HG13 ' A' ' 14' ' ' ILE . 43.0 m-85 -118.66 129.97 55.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.126 0.488 . . . . 0.0 111.656 -178.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.646 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 1.1 m-90 -118.47 142.62 47.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.387 179.47 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.615 HD21 ' CD1' ' A' ' 81' ' ' PHE . 1.5 mt -76.07 123.09 25.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.626 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -133.85 134.39 42.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.441 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.623 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.4 tt0 -114.78 115.15 26.56 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.182 -179.533 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.799 HG13 HD21 ' A' ' 75' ' ' LEU . 16.6 m -72.05 108.29 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-O 121.547 0.689 . . . . 0.0 110.143 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -57.07 -13.04 2.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.974 -178.774 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.696 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.2 t0 -107.87 116.6 32.24 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.012 0.434 . . . . 0.0 111.347 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -65.59 -38.96 90.99 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.323 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.39 25.74 6.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.511 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.696 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.1 p -51.37 146.33 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.834 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.1 pm0 -74.12 145.84 44.01 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.065 -179.357 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.708 HG13 ' CE2' ' A' ' 119' ' ' TYR . 32.7 mm -122.47 101.22 9.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.951 179.389 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.906 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -102.11 97.03 7.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.095 -179.468 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.592 ' HA ' ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -90.03 150.53 22.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.801 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.2 t -83.86 -168.13 2.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.09 1.58 10.79 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.552 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -98.83 -29.14 13.14 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.6 m80 -109.11 110.81 22.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.769 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.524 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 12.9 pt20 -89.53 -6.73 56.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.842 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -170.61 152.62 3.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.107 0.48 . . . . 0.0 111.838 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.708 ' CE2' HG13 ' A' ' 110' ' ' ILE . 32.7 p90 -133.23 175.81 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.306 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.604 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -157.54 166.32 33.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.368 0.604 . . . . 0.0 111.798 179.801 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.455 ' CH2' HG23 ' A' ' 103' ' ' VAL . 83.5 m95 -131.01 106.75 8.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.335 178.751 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.647 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -137.38 170.17 16.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.205 0.526 . . . . 0.0 111.518 -178.441 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.434 ' O ' ' HB1' ' A' ' 127' ' ' ALA . . . -74.71 -153.26 3.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.706 179.437 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.437 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.5 tp -77.23 -41.26 41.9 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.989 0.423 . . . . 0.0 111.264 179.724 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.6 pt-20 -61.25 -50.93 71.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.488 -179.566 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.687 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -71.65 -40.57 69.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.403 -179.347 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.477 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -62.25 -32.42 73.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.8 m -82.19 -31.13 30.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.569 179.162 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.687 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 1.2 pp0? -67.23 -44.75 78.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.011 -179.64 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.647 ' CD1' HD13 ' A' ' 122' ' ' LEU . 1.8 mt -74.71 -46.19 39.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.923 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.417 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -77.66 51.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.296 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.18 -26.99 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.88 -179.326 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.64 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.2 m-85 -61.03 119.43 8.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.413 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -44.89 -46.75 11.06 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.078 0.466 . . . . 0.0 111.87 -179.02 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.64 ' OE1' ' HB3' ' A' ' 133' ' ' PHE . 13.1 mp0 -52.46 -54.49 31.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.827 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.54 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.61 -41.37 98.94 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -178.595 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -55.77 -34.49 65.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.685 0.278 . . . . 0.0 110.344 179.729 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.481 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.79 -43.75 53.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.471 179.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.861 ' HB3' HD13 ' A' ' 14' ' ' ILE . . . -56.41 -45.54 80.62 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.302 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.58 -26.41 57.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.991 178.138 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.4 -52.06 37.15 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.31 0.576 . . . . 0.0 110.533 179.867 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.651 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 4.5 mm-40 -69.9 -28.99 66.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.861 -179.594 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.437 ' HA2' HD23 ' A' ' 100' ' ' LEU . . . -58.29 -47.98 86.33 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.313 179.589 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.514 ' NE2' HD13 ' A' ' 29' ' ' ILE . 0.9 OUTLIER -75.21 -33.08 61.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.984 0.421 . . . . 0.0 110.342 179.587 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . 0.409 ' OE1' ' HA ' ' A' ' 145' ' ' GLN . 4.4 tp60 -63.31 -51.88 64.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.716 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.416 ' CD1' HD11 ' A' ' 150' ' ' ILE . 30.8 t80 -61.93 -50.48 71.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.739 179.815 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.69 HD13 ' CZ ' ' A' ' 16' ' ' PHE . 69.9 mt -59.48 -34.11 72.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.1 t -74.02 -20.02 60.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.724 179.36 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.19 -10.49 41.51 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.937 -179.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.583 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 0.2 OUTLIER -86.86 -130.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.166 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.452 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 0.5 OUTLIER -178.05 -78.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.73 0.3 . . . . 0.0 110.816 179.611 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.42 156.81 36.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.913 0.387 . . . . 0.0 110.968 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 9.5 mt . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.741 179.679 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.588 ' C6 ' ' CE2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.521 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -72.44 101.52 1.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 124.328 3.352 . . . . 0.0 109.555 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.9 -40.69 3.11 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.982 0.42 . . . . 0.0 110.657 -179.948 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.19 -83.16 0.35 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.491 179.881 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 m -83.13 102.58 11.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.783 0.325 . . . . 0.0 110.918 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.465 ' HE1' ' HB2' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -72.61 126.66 30.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.667 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.667 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 57.82 168.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.381 0.61 . . . . 0.0 111.49 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.58 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -109.39 138.87 45.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.52 179.801 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.415 ' HB3' HG12 ' A' ' 50' ' ' VAL . 0.1 OUTLIER -79.11 128.52 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.984 -179.981 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.82 161.07 39.6 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.456 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 20.8 m -157.14 123.47 4.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.162 0.506 . . . . 0.0 111.212 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' A' ' 60' ' ' ALA . . . -117.49 170.85 13.66 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.483 178.79 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.405 HD21 ' HB2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -122.73 118.15 27.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.049 0.425 . . . . 0.0 111.669 -179.42 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.65 HG13 ' HB3' ' A' ' 98' ' ' TYR . 56.1 mt -83.01 91.22 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.432 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.128 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.613 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 29.6 mt -81.15 145.29 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.049 -178.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.703 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 46.2 p90 -151.91 121.19 6.77 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.016 -178.866 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.445 ' CD ' ' HA ' ' A' ' 106' ' ' TYR . 8.9 ttp180 -76.67 118.02 18.88 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.3 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.57 HH11 ' HB2' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -93.59 116.24 28.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.946 -178.378 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.83 160.64 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.488 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 tp -68.77 -85.51 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.163 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 2.7 pp -112.26 158.49 36.95 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.7 0.286 . . . . 0.0 111.619 -179.772 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.09 147.9 51.27 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.657 2.238 . . . . 0.0 112.105 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -79.2 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.665 179.966 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.4 m -133.12 -41.43 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.269 0.556 . . . . 0.0 110.931 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 176.24 32.82 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.628 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.41 -77.98 0.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.013 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -175.93 -178.85 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.834 179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.14 -53.41 2.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.07 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.703 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.3 mt -107.61 154.9 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.114 0.483 . . . . 0.0 111.772 -179.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.583 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.5 mp0 -138.37 127.32 23.94 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.121 179.659 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.614 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 55.2 m-85 -91.35 146.68 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.955 0.407 . . . . 0.0 112.036 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 43.5 tp -81.88 132.68 35.28 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.652 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.462 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.5 mt -133.14 142.74 48.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.968 0.413 . . . . 0.0 110.791 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.2 mt -121.81 104.2 9.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.522 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 3.8 tt0 -64.56 134.07 53.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.271 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.43 139.56 55.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.742 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 69.3 p -77.6 12.18 1.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.742 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -179.21 -171.5 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.659 0.266 . . . . 0.0 110.455 179.661 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.89 -122.98 5.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.245 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.535 ' CD1' ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -96.76 8.7 6.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.641 0.258 . . . . 0.0 111.343 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.8 36.82 15.94 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.337 0.589 . . . . 0.0 109.911 -178.973 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.563 ' HD1' ' H ' ' A' ' 42' ' ' HIS . 3.8 p-80 -79.35 155.2 28.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.211 -179.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.586 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.6 m95 -104.59 137.9 41.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.296 -179.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.5 136.68 6.23 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.985 -179.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.02 178.78 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.405 2.07 . . . . 0.0 111.656 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.477 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 50.9 Cg_exo -56.31 98.12 0.07 OUTLIER 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.437 2.091 . . . . 0.0 112.644 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -97.97 129.31 44.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.773 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -146.47 140.74 8.97 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.701 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 5.8 p80 -76.29 127.23 32.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.663 0.268 . . . . 0.0 110.798 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.509 ' HB ' HG21 ' A' ' 59' ' ' THR . 0.9 OUTLIER -88.72 137.32 21.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.984 0.421 . . . . 0.0 110.582 179.634 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 3.0 tt0 -89.72 152.12 46.48 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.544 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.4 Cg_endo -55.25 -22.91 34.7 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.524 2.149 . . . . 0.0 112.971 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.632 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.42 -11.83 43.57 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.383 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -88.05 158.64 18.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.603 0.24 . . . . 0.0 110.63 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.885 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 16.8 t0 -77.73 163.42 26.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.995 0.426 . . . . 0.0 110.22 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.87 -61.37 1.79 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.577 HD13 ' CD2' ' A' ' 99' ' ' TRP . 22.0 tp -64.32 -41.7 96.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.145 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.885 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 2.1 mt-10 -51.19 -45.15 61.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.687 -179.545 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.509 HG21 ' HB ' ' A' ' 50' ' ' VAL . 82.4 m -58.21 -40.91 82.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.149 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 12' ' ' GLY . . . -72.49 -30.62 64.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.905 178.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.539 HD12 ' HG ' ' A' ' 57' ' ' LEU . 96.0 mt -72.62 -52.47 15.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.421 179.349 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.48 -41.02 96.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.804 -179.659 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 46' ' ' PRO . . . -60.45 -33.64 72.86 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.147 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.587 HG22 ' CD1' ' A' ' 15' ' ' ILE . 24.5 m -60.14 -58.26 9.28 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.412 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.471 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -70.18 -20.31 63.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.621 179.47 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.4 tm-20 -79.06 -39.86 32.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.125 179.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.43 ' O ' HD22 ' A' ' 112' ' ' LEU . 10.3 mm-40 -106.38 -5.3 19.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.934 -179.309 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.47 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -138.46 -11.76 1.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.525 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.653 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.38 -3.85 51.9 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.857 -1.164 . . . . 0.0 112.85 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.519 ' CG2' ' HB3' ' A' ' 74' ' ' GLN . 5.0 mt -99.01 121.79 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.535 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 pm0 -105.11 171.06 7.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.523 0.202 . . . . 0.0 111.208 -179.387 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.595 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -48.93 -31.7 7.78 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.698 179.921 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.89 -23.85 75.46 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.317 -0.944 . . . . 0.0 111.857 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.519 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 2.5 tp60 -95.03 3.85 54.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 0.0 110.921 179.655 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.67 HD22 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -141.48 -169.25 2.83 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.289 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.492 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -137.23 100.3 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.364 -179.671 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.66 HD11 ' HB3' ' A' ' 101' ' ' ALA . 10.1 mm -71.59 126.92 32.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.96 179.74 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.524 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -90.02 137.69 20.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.062 0.458 . . . . 0.0 111.07 -179.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -97.85 149.95 21.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.397 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.21 -27.1 21.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.352 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.556 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 15.0 t80 -105.03 126.02 51.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.733 0.301 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.504 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.57 124.56 5.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.257 0.551 . . . . 0.0 111.524 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.76 140.71 21.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.464 179.053 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.679 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 4.0 pm0 -121.19 138.26 54.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.05 0.452 . . . . 0.0 111.771 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.595 HD11 ' HE2' ' A' ' 98' ' ' TYR . 6.4 mt -98.87 116.91 32.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.622 179.457 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.468 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.1 p30 -113.86 125.66 54.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.5 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 10.1 p90 -166.67 146.25 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.572 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 88' ' ' VAL . 9.9 p -82.37 110.71 17.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.332 179.561 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.441 ' HB3' " C4'" ' A' ' 154' ' ' ATP . . . -80.78 -95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.627 -179.066 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.437 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -67.28 -41.17 85.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.872 0.368 . . . . 0.0 110.655 -179.923 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.477 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER 178.12 26.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.278 179.766 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.58 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.48 129.94 4.24 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.447 179.591 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.667 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 56.5 Cg_endo -70.07 119.58 6.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.208 2.605 . . . . 0.0 112.998 -179.195 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.547 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 7.4 mmmt -104.3 121.9 44.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.047 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 30.0 m -87.94 116.81 26.37 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.679 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.1 t -115.81 108.9 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.859 -178.114 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.618 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.6 mm -86.0 126.63 40.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.374 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.65 ' HB3' HG13 ' A' ' 14' ' ' ILE . 13.8 m-85 -113.27 133.25 55.2 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.085 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.577 ' CD2' HD13 ' A' ' 57' ' ' LEU . 9.3 m-90 -117.83 141.43 48.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.949 178.566 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.477 ' CD2' ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -78.07 115.65 17.96 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.791 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.66 ' HB3' HD11 ' A' ' 77' ' ' ILE . . . -124.55 144.4 50.15 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.16 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.455 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.3 tt0 -123.1 116.38 23.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.81 0.338 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.67 HG13 HD22 ' A' ' 75' ' ' LEU . 11.2 m -73.22 115.01 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.431 0.634 . . . . 0.0 110.705 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.498 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.17 -11.95 17.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.607 -179.188 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.793 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 66.9 t0 -114.12 121.55 44.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.619 179.278 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.445 ' HA ' ' CD ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -70.59 -47.47 60.01 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.581 0.705 . . . . 0.0 109.456 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.542 ' CG ' ' HD2' ' A' ' 105' ' ' ASP . 4.1 p-10 -85.03 16.49 3.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.057 178.491 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.793 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.8 p -46.14 144.53 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.153 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.101 179.909 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.475 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.6 OUTLIER -66.82 143.95 56.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 111.755 -179.033 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.611 HG13 ' CE2' ' A' ' 119' ' ' TYR . 42.0 mm -123.45 99.8 7.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.81 -1.087 . . . . 0.0 110.222 179.37 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.653 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 23.8 mtp180 -102.13 103.08 13.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.332 -178.658 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 67' ' ' GLU . 11.3 mt -98.85 135.6 40.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -164.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.113 179.343 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 14.4 0.92 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 179.681 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.62 -36.15 7.58 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.843 0.354 . . . . 0.0 110.886 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.405 ' CD2' ' HB3' ' A' ' 67' ' ' GLU . 75.3 m-70 -113.31 115.68 28.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.607 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.742 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 1.6 pt20 -86.93 -14.36 42.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.827 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -160.05 153.11 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.07 0.462 . . . . 0.0 112.131 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.611 ' CE2' HG13 ' A' ' 110' ' ' ILE . 45.0 p90 -133.19 171.41 14.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.168 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.413 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 3.6 mtt180 -157.37 160.3 38.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.213 0.53 . . . . 0.0 111.846 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.467 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.2 m95 -124.21 107.67 11.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.791 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.534 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -139.47 168.49 19.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.942 -178.303 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . -73.73 -153.94 2.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.998 179.59 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 12.4 tp -77.33 -41.6 39.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.828 0.347 . . . . 0.0 111.119 -179.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.6 pt-20 -61.43 -50.23 73.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.619 -179.449 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.796 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.93 -45.8 63.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.87 0.366 . . . . 0.0 110.531 -179.47 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.462 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.89 -30.46 63.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 109.802 179.174 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.402 ' O ' ' HD2' ' A' ' 137' ' ' LYS . 9.7 m -84.38 -31.98 24.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.271 178.634 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.796 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.01 -43.79 91.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.872 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.638 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.1 mt -77.72 -42.55 33.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.954 179.281 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.2 53.5 1.24 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.439 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.19 -32.14 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 114.885 -1.052 . . . . 0.0 111.876 -178.932 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.541 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 40.9 m-85 -59.74 120.75 10.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.308 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -46.32 -52.27 13.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.301 0.572 . . . . 0.0 111.26 -179.453 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.541 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 15.9 mp0 -43.6 -54.39 4.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.829 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.39 -34.06 77.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.872 0.368 . . . . 0.0 110.584 -179.498 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -59.91 -35.32 74.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.408 179.545 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.42 -45.29 22.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.794 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.622 ' HB3' HD12 ' A' ' 14' ' ' ILE . . . -52.84 -55.38 23.48 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.114 179.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.8 -27.56 69.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.455 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.49 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.99 -51.77 35.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.029 -179.9 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.556 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 71.1 mm-40 -71.26 -30.96 66.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.425 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.32 -47.63 88.45 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.651 179.105 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 29.8 t-80 -74.58 -31.69 62.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.803 0.335 . . . . 0.0 110.435 179.192 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -64.68 -53.2 51.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.348 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.505 ' CE1' HD12 ' A' ' 150' ' ' ILE . 14.8 t80 -62.16 -48.9 78.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.747 -179.635 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.627 HD11 ' CE1' ' A' ' 16' ' ' PHE . 79.3 mt -60.91 -26.99 67.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.532 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.7 t -76.04 -17.13 59.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.782 0.325 . . . . 0.0 110.792 179.443 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 m -92.46 -12.49 31.93 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.598 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.548 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 0.0 OUTLIER -91.29 -133.72 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 179.808 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . 0.448 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 1.0 OUTLIER -165.28 -72.63 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.956 0.408 . . . . 0.0 110.136 179.698 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 53.34 17.01 0.96 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.525 . . . . 0.0 112.186 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.834 -0.167 . . . . 0.0 111.033 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.559 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.764 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.507 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.764 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 82.4 Cg_endo -72.36 24.88 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 124.328 3.352 . . . . 0.0 109.619 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.535 ' H ' ' C ' ' A' ' 1' ' ' GLY . 2.8 mp -115.87 16.22 16.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.309 -179.847 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.85 93.45 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.516 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.96 158.78 27.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 0.0 110.887 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.3 ptm -168.61 -178.36 3.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.753 -179.932 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' HB3' ' HG2' ' A' ' 93' ' ' PRO . . . 69.54 172.52 0.3 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.062 0.458 . . . . 0.0 111.351 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.574 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -118.22 137.19 53.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.309 179.565 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.65 115.74 24.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.146 -179.665 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.596 ' HB3' ' HG2' ' A' ' 94' ' ' LYS . . . -126.84 174.59 8.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.531 ' HB2' HG22 ' A' ' 59' ' ' THR . 9.7 m -164.04 124.91 2.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.164 0.507 . . . . 0.0 111.186 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.542 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.94 175.88 15.9 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.519 HD22 ' O ' ' A' ' 99' ' ' TRP . 1.2 mt -128.99 119.4 24.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.466 0.633 . . . . 0.0 112.693 -178.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.549 ' CG1' ' HB3' ' A' ' 98' ' ' TYR . 14.2 mm -77.0 91.61 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.225 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.657 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 58.7 mt -88.01 141.83 13.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.601 -178.287 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.794 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 54.8 p90 -152.23 122.42 7.16 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -179.116 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.437 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 9.2 ptt85 -83.69 114.31 21.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.251 179.31 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -101.62 112.36 24.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.95 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 160.32 8.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 21' ' ' ILE . 13.9 mt -46.62 -56.4 6.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.73 -179.918 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.472 HG23 ' O ' ' A' ' 20' ' ' LEU . 0.9 OUTLIER -152.1 154.25 32.22 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.031 179.419 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.464 ' O ' ' HE2' ' A' ' 23' ' ' LYS . 28.0 Cg_exo -61.88 156.94 45.88 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.697 2.265 . . . . 0.0 112.18 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.464 ' HE2' ' O ' ' A' ' 22' ' ' PRO . 1.7 mmpt? -132.33 -81.19 0.5 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.759 0.314 . . . . 0.0 111.163 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 19.9 t -93.66 -3.87 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.623 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.83 32.8 5.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.916 0.389 . . . . 0.0 110.822 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -89.54 -68.59 0.77 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.138 -179.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -145.08 98.58 3.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.691 179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -86.94 -47.75 8.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.668 -179.116 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.798 ' HB ' ' HE2' ' A' ' 144' ' ' HIS . 4.1 mt -106.29 143.54 17.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.113 -179.05 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.728 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.6 OUTLIER -137.28 132.94 34.43 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.244 179.45 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.657 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 45.0 m-85 -94.75 143.52 26.38 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.072 0.463 . . . . 0.0 112.233 -178.682 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.571 HD22 HD11 ' A' ' 15' ' ' ILE . 50.0 tp -79.59 132.87 36.39 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.339 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.545 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.7 mt -135.04 140.71 45.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.648 179.833 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.663 HD21 HD23 ' A' ' 112' ' ' LEU . 8.7 mt -117.86 123.79 46.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 -178.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.495 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 1.2 tt0 -68.59 151.71 46.36 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.135 -179.414 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' ' 37' ' ' SER . . . -83.24 -12.11 57.11 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.847 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 44.4 t 72.22 -60.17 0.54 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.477 0.18 . . . . 0.0 111.306 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -110.8 -174.49 2.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.836 0.351 . . . . 0.0 110.896 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.3 -132.73 33.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.287 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.536 HG23 ' HD1' ' A' ' 42' ' ' HIS . 9.3 tt -82.29 1.02 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-O 120.648 0.261 . . . . 0.0 111.434 -179.897 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 61.33 24.11 14.26 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.787 0.327 . . . . 0.0 111.162 179.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.536 ' HD1' HG23 ' A' ' 40' ' ' ILE . 41.8 p-80 -60.38 148.14 38.24 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.884 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.624 ' CD1' HD21 ' A' ' 130' ' ' LEU . 26.8 m95 -103.05 110.31 22.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.386 179.733 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.627 ' HB ' ' HE2' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -126.91 128.47 24.21 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.778 -179.323 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.536 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 49.2 Cg_exo -55.9 168.18 1.93 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.326 2.017 . . . . 0.0 112.493 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.653 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 15.2 Cg_endo -59.79 101.04 0.14 Allowed 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 123.148 2.565 . . . . 0.0 112.875 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HE2' ' HB ' ' A' ' 44' ' ' THR . 4.7 mtmt -103.52 129.57 50.73 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.852 0.358 . . . . 0.0 111.093 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -111.13 -179.37 20.25 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.345 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -120.02 104.84 10.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 110.69 179.692 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.694 ' N ' HG23 ' A' ' 59' ' ' THR . 1.6 p -76.2 129.04 37.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.042 0.449 . . . . 0.0 111.193 -179.138 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.646 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -92.4 177.01 2.28 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.539 -179.596 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.646 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.0 Cg_exo -57.42 -60.25 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.684 2.256 . . . . 0.0 112.72 -178.992 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.54 0.13 88.41 Favored Glycine 0 CA--C 1.517 0.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.694 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.603 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 17.6 tt0 -78.73 171.98 14.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.35 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.962 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.4 t70 -98.6 158.69 15.44 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.208 0.527 . . . . 0.0 110.056 178.896 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.551 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.755 -179.074 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.658 ' HG ' HD11 ' A' ' 61' ' ' LEU . 33.1 tp -65.2 -39.04 92.3 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.668 0.27 . . . . 0.0 111.223 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.962 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -49.1 -45.38 43.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.665 179.675 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.694 HG23 ' N ' ' A' ' 50' ' ' VAL . 66.6 m -59.83 -48.62 80.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.33 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.51 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -64.64 -28.02 69.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.158 178.694 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.658 HD11 ' HG ' ' A' ' 57' ' ' LEU . 93.2 mt -76.35 -51.67 11.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.25 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -63.08 -35.18 79.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.413 ' HA ' ' HB2' ' A' ' 66' ' ' GLU . . . -65.72 -38.23 88.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.269 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.609 HG22 ' O ' ' A' ' 70' ' ' ILE . 56.2 m -56.15 -51.21 68.8 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.593 179.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.459 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.2 pt20 -76.03 -21.97 56.26 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.961 179.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 0.9 OUTLIER -75.9 -35.89 59.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.214 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.653 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 2.8 mm-40 -112.04 -4.99 14.33 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.529 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -136.92 -6.65 1.87 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 179.697 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.518 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 72.94 -7.73 9.11 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.219 -0.991 . . . . 0.0 113.804 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.609 ' O ' HG22 ' A' ' 64' ' ' THR . 1.0 OUTLIER -96.6 129.14 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.005 0.431 . . . . 0.0 111.161 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.401 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.9 pt-20 -110.63 170.2 8.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 -179.682 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.544 ' HA ' ' CD1' ' A' ' 75' ' ' LEU . . . -46.13 -36.3 5.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.156 179.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.87 -24.04 74.27 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.53 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.572 ' CB ' HG22 ' A' ' 70' ' ' ILE . 5.8 mm100 -97.1 -4.04 40.14 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.676 -0.308 . . . . 0.0 111.485 -179.673 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.817 HD21 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -131.59 -170.93 2.48 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.898 0.38 . . . . 0.0 110.257 178.128 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.426 ' H ' ' H ' ' A' ' 102' ' ' GLU . 34.6 m -133.65 100.06 4.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.605 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.672 HD12 ' HB3' ' A' ' 101' ' ' ALA . 12.2 mm -72.26 113.11 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.732 -179.608 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.73 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.2 mp -73.49 144.95 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.845 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -100.17 148.96 24.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.205 -179.65 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.1 -17.44 57.09 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.714 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.503 ' CG ' ' HG ' ' A' ' 100' ' ' LEU . 30.5 t80 -100.3 102.45 13.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.443 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -126.02 135.59 51.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.004 0.431 . . . . 0.0 110.42 179.366 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.627 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -163.56 145.93 9.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.574 179.962 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.688 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 1.0 OUTLIER -136.15 116.43 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.983 0.421 . . . . 0.0 111.908 179.88 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.516 HD13 ' C ' ' A' ' 135' ' ' GLU . 6.9 mt -77.73 119.17 20.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.956 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -112.82 119.98 39.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.862 -179.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 7.8 p90 -167.28 144.34 4.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.258 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.643 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.2 p -81.84 115.38 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.416 0.627 . . . . 0.0 110.387 179.156 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.49 ' HB2' " O4'" ' A' ' 154' ' ' ATP . . . -72.72 -98.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.938 -178.309 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.46 ' H ' ' HB3' ' A' ' 89' ' ' ALA . 0.0 OUTLIER -78.39 -35.55 47.09 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.099 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.538 ' O ' ' HE2' ' A' ' 92' ' ' LYS . 1.1 m-20 -174.6 18.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.359 179.616 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -150.77 128.39 5.67 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-O 120.992 0.425 . . . . 0.0 110.883 -179.94 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.643 ' HA ' ' HA ' ' A' ' 88' ' ' VAL . 60.3 Cg_endo -74.09 118.32 5.35 Favored 'Trans proline' 0 CA--C 1.509 -0.768 0 C-N-CA 123.397 2.732 . . . . 0.0 112.973 -179.293 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.596 ' HG2' ' HB3' ' A' ' 10' ' ' ALA . 4.5 ttpt -101.53 121.82 42.68 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.168 -179.373 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.543 HG22 ' HB2' ' A' ' 84' ' ' GLU . 24.1 m -86.69 108.06 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 178.272 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.688 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 30.0 t -105.92 108.19 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.706 -178.591 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.754 HG22 ' CH2' ' A' ' 99' ' ' TRP . 1.3 mm -85.92 124.75 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.31 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.549 ' HB3' ' CG1' ' A' ' 14' ' ' ILE . 35.9 m-85 -110.72 130.83 55.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.847 -178.203 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.754 ' CH2' HG22 ' A' ' 97' ' ' ILE . 6.3 m-90 -116.49 150.54 37.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.783 178.43 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.73 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 26.2 mt -78.89 132.88 36.94 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.672 ' HB3' HD12 ' A' ' 77' ' ' ILE . . . -139.98 140.96 36.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.994 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.557 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.4 tt0 -123.91 113.43 18.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.751 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.817 HG13 HD21 ' A' ' 75' ' ' LEU . 17.1 m -72.21 110.23 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 121.416 0.627 . . . . 0.0 110.396 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -58.56 -13.48 5.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.918 -179.038 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.7 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 65.0 t0 -108.26 114.76 28.88 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.025 0.441 . . . . 0.0 111.526 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . 0.42 ' CE1' ' CD ' ' A' ' 17' ' ' ARG . 0.5 OUTLIER -61.91 -42.54 99.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.121 179.357 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.451 ' CG ' ' HD2' ' A' ' 105' ' ' ASP . 4.2 p-10 -96.58 25.23 5.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.103 179.014 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.7 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.7 p -49.33 147.28 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.347 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.427 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.7 pm0 -72.43 142.73 48.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.321 0.581 . . . . 0.0 110.822 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.821 ' CG2' HD21 ' A' ' 112' ' ' LEU . 44.4 mm -121.48 98.69 6.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.518 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.99 101.89 13.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.531 -179.169 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.821 HD21 ' CG2' ' A' ' 110' ' ' ILE . 4.5 mt -92.07 160.81 15.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.016 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.21 -170.82 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.649 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -66.34 -34.67 78.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.324 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.19 -6.4 49.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.591 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.551 ' CB ' ' HB3' ' A' ' 112' ' ' LEU . 3.1 m-70 -110.93 127.86 55.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 111.131 -179.671 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.847 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 1.4 pp0? -99.41 -23.2 15.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.068 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.4 -177.57 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 111.956 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.767 ' CE2' HG13 ' A' ' 110' ' ' ILE . 40.7 p90 -147.44 169.51 19.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.186 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.456 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 96.5 mtt180 -153.89 154.72 34.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.236 0.541 . . . . 0.0 111.63 -179.859 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.522 ' CH2' HG21 ' A' ' 103' ' ' VAL . 78.3 m95 -119.31 107.06 12.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.468 178.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.734 HD11 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -137.28 169.31 18.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.102 0.477 . . . . 0.0 111.632 -178.144 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.455 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . -71.42 -154.05 1.58 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.731 179.499 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.765 ' HB2' ' HD1' ' A' ' 144' ' ' HIS . 7.0 tp -76.79 -42.55 40.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.864 0.364 . . . . 0.0 111.359 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.513 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.8 pt-20 -63.08 -47.16 84.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.819 -179.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.658 ' O ' ' HG3' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.54 -38.83 62.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.941 0.401 . . . . 0.0 110.544 -179.741 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.545 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -64.29 -29.52 70.61 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.496 0.665 . . . . 0.0 109.209 178.465 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.417 ' SG ' ' HG3' ' A' ' 137' ' ' LYS . 43.9 m -84.01 -36.35 23.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.611 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.658 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.8 OUTLIER -59.35 -44.79 92.63 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.742 -179.95 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.734 ' CD1' HD11 ' A' ' 122' ' ' LEU . 1.0 OUTLIER -75.85 -39.69 56.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.701 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.9 52.59 1.26 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.176 178.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . 0.421 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.92 -31.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.59 -178.815 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.783 ' HB3' ' HE2' ' A' ' 135' ' ' GLU . 25.5 m-85 -63.18 121.29 13.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.705 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 137' ' ' LYS . 9.3 tttt -46.48 -54.31 9.5 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.158 0.504 . . . . 0.0 111.853 -179.494 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.783 ' HE2' ' HB3' ' A' ' 133' ' ' PHE . 14.0 mp0 -41.29 -54.92 2.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.1 -179.24 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.691 ' HA ' ' HE1' ' A' ' 136' ' ' MET . 0.0 OUTLIER -63.23 -30.92 71.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.331 . . . . 0.0 110.613 179.875 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -58.07 -36.58 73.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.899 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.556 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -76.99 -46.95 22.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.215 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -50.81 -50.82 55.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.074 0.464 . . . . 0.0 110.209 179.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . 0.401 HD21 ' HB1' ' A' ' 127' ' ' ALA . 0.8 OUTLIER -72.15 -32.01 66.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.994 178.798 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.556 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -59.06 -51.99 67.66 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.893 -179.753 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.449 ' CB ' ' HE2' ' A' ' 81' ' ' PHE . 1.5 mt-10 -69.57 -27.6 65.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.366 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.91 -48.62 65.92 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.916 179.42 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.798 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.6 OUTLIER -80.7 -32.72 35.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.078 0.466 . . . . 0.0 110.325 179.551 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -65.96 -52.62 48.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.972 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . 0.529 ' CD1' HD11 ' A' ' 150' ' ' ILE . 24.1 t80 -61.63 -53.48 55.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.622 -179.806 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.639 HD12 ' CZ ' ' A' ' 16' ' ' PHE . 92.8 mt -57.61 -29.94 64.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.463 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -24.46 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.546 179.549 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -12.03 49.11 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.24 -179.774 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.546 ' CD1' HD22 ' A' ' 147' ' ' LEU . 1.2 mt -87.25 -128.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -150.21 -66.13 0.2 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.798 0.333 . . . . 0.0 110.776 179.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -170.09 109.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.477 HD11 HG13 ' A' ' 78' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.956 -179.924 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.593 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.41 -24.99 18.72 Favored 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 124.314 3.343 . . . . 0.0 109.593 -179.915 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.3 mt -123.79 -69.94 0.79 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.891 0.377 . . . . 0.0 111.012 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.78 -85.31 0.19 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.611 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.69 137.62 52.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 110.966 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.571 ' HE3' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -91.0 128.32 36.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.938 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.601 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 78.58 165.95 0.21 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.474 179.461 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.657 HD13 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.6 131.58 54.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.282 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.62 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 2.5 mtm180 -81.89 128.35 33.95 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.836 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.62 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.32 156.27 44.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.852 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 56.9 m -149.3 124.06 9.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.002 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.623 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.44 168.91 13.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.672 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.558 HD11 ' CD1' ' A' ' 77' ' ' ILE . 1.5 mt -118.99 117.68 29.44 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.833 -179.094 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.771 HG13 ' HB3' ' A' ' 98' ' ' TYR . 38.7 mt -82.18 92.37 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.686 ' O ' ' HA ' ' A' ' 31' ' ' PHE . 27.7 mt -86.39 145.57 7.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.783 -177.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.81 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.3 p90 -150.83 123.67 8.64 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -178.967 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.579 ' HG2' HG23 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -82.1 112.53 19.23 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -103.91 120.2 40.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.046 -179.858 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.36 159.26 19.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.478 179.6 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.1 tp -60.88 -80.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.986 -179.809 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 22' ' ' PRO . 2.8 pp -109.04 149.75 40.05 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.046 179.898 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 16.5 Cg_exo -67.29 152.51 79.19 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.571 2.181 . . . . 0.0 112.187 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.35 -76.15 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.701 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.559 HG11 ' O ' ' A' ' 24' ' ' VAL . 18.8 t -99.58 -1.62 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.232 179.692 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.5 t70 63.54 40.84 7.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.143 0.497 . . . . 0.0 110.307 -179.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.95 -46.0 4.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.179 -179.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -160.54 116.92 2.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -92.63 -51.34 5.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.642 -179.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ILE . . . . . 0.81 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.9 mt -98.64 147.26 7.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.205 0.526 . . . . 0.0 112.143 -178.839 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.623 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.9 mt-10 -138.92 124.68 19.7 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.776 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.686 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.1 m-85 -88.76 147.1 24.64 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.685 HD21 HD11 ' A' ' 15' ' ' ILE . 45.5 tp -85.87 132.62 34.06 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.843 178.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 43' ' ' TRP . 4.4 mt -133.03 144.55 50.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.878 0.37 . . . . 0.0 110.757 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.633 HD23 HD23 ' A' ' 112' ' ' LEU . 63.4 mt -123.31 106.71 10.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.052 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.489 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -60.02 139.05 57.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.27 135.48 50.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.504 179.347 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.601 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 92.5 p -81.04 20.91 0.75 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.376 179.967 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -179.42 -173.05 0.25 Allowed 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.102 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.89 -135.65 18.31 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.323 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.601 HD13 ' HB3' ' A' ' 42' ' ' HIS . 1.1 pt -87.57 9.99 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.436 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 0.4 OUTLIER 66.45 38.46 4.26 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.533 0.683 . . . . 0.0 109.637 -179.103 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' HIS . . . . . 0.669 ' HE2' H5'1 ' A' ' 154' ' ' ATP . 1.8 p-80 -85.82 152.99 22.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.922 -179.587 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.642 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 54.9 m95 -100.05 157.94 16.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.093 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -173.19 130.62 0.57 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.221 -179.851 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -50.99 169.12 0.19 Allowed 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.025 1.817 . . . . 0.0 112.091 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' PRO . . . . . 0.809 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 16.5 Cg_exo -64.25 81.14 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.492 2.128 . . . . 0.0 111.847 179.606 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.623 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -104.55 151.92 23.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.133 -179.786 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.65 -172.69 12.87 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.592 -179.814 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 p80 -109.74 110.82 21.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.713 0.292 . . . . 0.0 110.456 179.636 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.62 ' O ' ' HB3' ' A' ' 9' ' ' ARG . 1.8 p -79.71 132.97 30.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.507 0.67 . . . . 0.0 111.135 -179.083 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.716 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.9 tt0 -91.03 152.79 44.6 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.524 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 19.6 Cg_endo -57.17 -15.86 19.65 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.647 2.231 . . . . 0.0 112.525 -179.292 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.716 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -106.23 -11.44 27.63 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 178.982 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -87.83 170.92 10.77 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . 0.957 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -87.52 162.08 17.42 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . 0.486 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 9.6 m-20 -73.91 -63.5 1.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.864 -179.368 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.648 ' HG ' HD13 ' A' ' 61' ' ' LEU . 23.3 tp -64.63 -39.06 93.03 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.685 0.279 . . . . 0.0 110.639 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.957 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.76 -45.71 59.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.653 179.277 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.59 HG22 ' N ' ' A' ' 50' ' ' VAL . 92.4 m -59.5 -43.46 93.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.199 0.523 . . . . 0.0 109.655 179.513 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 12' ' ' GLY . . . -71.39 -29.73 65.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.194 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.96 HD21 ' HB1' ' A' ' 72' ' ' ALA . 94.1 mt -74.9 -52.97 9.9 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.038 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.13 -38.08 85.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.641 -179.849 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.465 ' HB2' ' O ' ' A' ' 59' ' ' THR . . . -63.39 -33.8 76.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.025 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.809 ' HA ' ' HB2' ' A' ' 46' ' ' PRO . 40.9 m -62.58 -54.71 35.59 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.572 179.44 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.526 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.47 -25.03 61.28 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.697 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 3.2 mm-40 -78.06 -33.55 50.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.076 179.53 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.584 ' HB3' ' HD1' ' A' ' 116' ' ' HIS . 57.3 mt-10 -112.9 6.94 18.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.959 -179.173 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.617 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.01 -7.21 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.581 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 72.62 -3.24 26.91 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.461 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.591 HG21 ' CD2' ' A' ' 75' ' ' LEU . 1.3 mt -101.02 120.69 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-O 121.154 0.502 . . . . 0.0 110.97 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.445 ' C ' HD12 ' A' ' 75' ' ' LEU . 1.1 pt-20 -106.15 170.69 7.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.198 -179.217 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.96 ' HB1' HD21 ' A' ' 61' ' ' LEU . . . -49.56 -33.03 13.86 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.124 0.488 . . . . 0.0 110.251 179.064 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.505 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -70.66 -11.46 68.95 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.479 179.837 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.558 HE21 ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -113.7 -13.47 12.68 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.822 0.311 . . . . 0.0 111.053 179.286 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.728 HD22 HG13 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -120.32 -173.13 2.5 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.805 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.504 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 33.8 m -131.62 98.12 4.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.384 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.612 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 14.8 mm -70.64 102.17 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.361 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.461 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -65.3 140.02 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 110.437 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -97.83 150.97 20.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.555 -179.658 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.13 -21.85 38.49 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.651 179.634 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.494 ' CB ' HD11 ' A' ' 100' ' ' LEU . 12.3 t80 -108.93 126.17 52.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.816 0.341 . . . . 0.0 111.368 -179.59 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.668 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.8 134.29 8.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.188 179.51 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -157.78 145.66 18.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.708 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 0.1 OUTLIER -123.48 136.18 54.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 179.561 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.479 HD11 ' C ' ' A' ' 135' ' ' GLU . 10.8 mt -100.01 119.09 37.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.097 179.761 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.7 118.64 37.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.466 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.542 ' CD2' ' HG2' ' A' ' 135' ' ' GLU . 17.1 p90 -167.22 147.41 5.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.012 179.748 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.702 HG11 ' O ' ' A' ' 88' ' ' VAL . 9.9 p -83.81 112.88 21.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 179.232 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.597 ' CB ' " H4'" ' A' ' 154' ' ' ATP . . . -79.85 -100.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.761 -178.494 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -45.84 88.99 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.143 0.497 . . . . 0.0 110.241 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.497 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 1.1 t30 -174.74 21.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.218 179.531 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.657 ' HB3' HD13 ' A' ' 8' ' ' LEU . 7.8 tptt -151.25 130.91 6.73 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.601 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 48.2 Cg_endo -67.74 118.61 5.73 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.388 2.725 . . . . 0.0 112.554 -179.436 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.582 ' HG2' ' CD1' ' A' ' 8' ' ' LEU . 8.5 mtpp -106.15 123.37 47.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.65 -178.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.8 m -89.21 105.75 17.99 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.292 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.735 HG11 ' CE2' ' A' ' 98' ' ' TYR . 20.3 t -105.7 108.19 24.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.819 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.655 ' CD1' ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -87.41 126.55 41.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 178.062 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.771 ' HB3' HG13 ' A' ' 14' ' ' ILE . 39.1 m-85 -114.9 128.88 56.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.109 0.481 . . . . 0.0 111.76 -178.775 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.668 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -113.29 147.24 37.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.106 179.198 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.646 HD13 HD22 ' A' ' 147' ' ' LEU . 12.9 mt -78.37 132.93 37.58 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . 0.603 ' HB3' HD13 ' A' ' 77' ' ' ILE . . . -142.71 144.57 32.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.908 0.385 . . . . 0.0 111.286 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.446 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.3 tm-20 -124.6 114.7 19.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.491 179.153 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.728 HG13 HD22 ' A' ' 75' ' ' LEU . 5.1 m -71.85 123.7 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-O 121.376 0.607 . . . . 0.0 110.065 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 1.4 mttm -60.13 -28.58 68.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.29 -177.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' ASP . . . . . 0.695 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.3 t0 -102.11 121.35 42.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 0.0 111.722 -178.902 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -43.63 94.28 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.81 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -99.66 25.9 6.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.703 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.695 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.8 p -42.99 151.39 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.332 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' GLU . . . . . 0.402 ' N ' HG23 ' A' ' 108' ' ' VAL . 6.3 pm0 -69.95 141.85 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.174 0.511 . . . . 0.0 111.233 -179.209 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.722 HG13 ' CE2' ' A' ' 119' ' ' TYR . 37.3 mm -120.34 98.01 5.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.808 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' ARG . . . . . 0.581 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 3.3 mtp180 -98.32 97.51 8.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.554 -179.128 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.633 HD23 HD23 ' A' ' 34' ' ' LEU . 10.2 mt -92.66 125.51 37.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.43 ' C ' ' H ' ' A' ' 115' ' ' GLU . 54.5 m -82.8 -166.38 1.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.357 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -75.7 19.47 0.2 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.64 0.257 . . . . 0.0 111.329 179.784 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' GLU . . . . . 0.43 ' H ' ' C ' ' A' ' 113' ' ' SER . 50.7 mt-10 -105.26 -34.11 7.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.788 0.327 . . . . 0.0 110.626 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.592 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 11.0 m80 -118.1 137.32 53.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.601 ' HB2' ' HA ' ' A' ' 37' ' ' SER . 8.1 tp-100 -85.27 -27.29 26.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.842 -179.437 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.0 174.35 6.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 111.583 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.722 ' CE2' HG13 ' A' ' 110' ' ' ILE . 23.6 p90 -136.97 174.01 11.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.509 -179.266 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.464 ' HG3' ' CH2' ' A' ' 43' ' ' TRP . 1.7 mtt-85 -157.94 162.38 38.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.215 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' TRP . . . . . 0.556 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -131.0 107.16 8.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.861 179.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.558 ' CD2' ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.89 172.36 12.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.012 0.434 . . . . 0.0 111.42 -178.838 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.426 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . -78.81 -151.7 5.95 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.732 -0.746 . . . . 0.0 111.665 179.405 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 141' ' ' GLN . 5.5 tp -77.53 -39.74 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.797 0.332 . . . . 0.0 111.187 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.487 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -63.03 -50.62 69.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.797 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . 0.558 ' HB3' ' CD2' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -71.39 -46.9 59.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.111 -179.564 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.481 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.11 -27.55 54.29 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.225 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' CYS . . . . . 0.47 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -82.5 -31.77 29.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.647 178.58 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.685 HE21 ' HG ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -65.99 -45.24 82.34 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.096 -179.676 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.685 ' HG ' HE21 ' A' ' 129' ' ' GLN . 0.5 OUTLIER -78.47 -40.01 36.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.359 179.239 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.535 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -73.72 49.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.771 179.583 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.82 -31.23 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.151 -179.182 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.505 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 11.4 m-85 -61.6 118.75 7.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.83 0.348 . . . . 0.0 110.7 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -46.24 -38.11 8.06 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.542 ' HG2' ' CD2' ' A' ' 87' ' ' TYR . 1.8 mp0 -59.65 -56.98 15.08 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.273 -179.391 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 136' ' ' MET . . . . . 0.535 ' CB ' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -54.33 -45.13 72.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.028 -179.406 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 137' ' ' LYS . . . . . 0.58 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.06 -35.3 46.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.591 179.672 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.489 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.47 -46.51 22.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.681 179.882 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 139' ' ' ALA . . . . . 0.446 ' CB ' HD13 ' A' ' 14' ' ' ILE . . . -53.11 -48.36 67.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.442 179.425 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.48 -25.98 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.092 178.854 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.58 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.46 -51.83 52.65 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.09 179.942 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 142' ' ' GLU . . . . . 0.475 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 10.0 mm-40 -69.93 -28.74 65.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.513 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.8 93.01 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.04 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 144' ' ' HIS . . . . . 0.527 ' CD2' HD12 ' A' ' 29' ' ' ILE . 5.7 t-80 -76.11 -28.84 57.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.342 179.394 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -70.6 -50.1 40.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.091 -179.888 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -67.8 -52.08 41.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.149 -179.667 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.646 HD11 ' CZ ' ' A' ' 16' ' ' PHE . 96.1 mt -57.27 -27.71 62.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.529 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.53 -21.73 66.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.683 179.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.43 -6.63 56.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.895 -179.687 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 150' ' ' ILE . . . . . 0.563 ' CD1' HD23 ' A' ' 147' ' ' LEU . 1.1 mt -96.87 -131.85 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 -179.893 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -175.77 -72.94 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.86 0.362 . . . . 0.0 110.842 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -176.49 -179.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 154' ' ' ATP . . . . . 0.669 H5'1 ' HE2' ' A' ' 42' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.214 0.53 . . . . 0.0 111.399 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -106.53 139.2 41.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.788 -179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.627 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.37 125.37 33.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.13 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.565 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -136.09 167.01 22.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.744 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.502 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -157.83 123.89 4.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.079 0.466 . . . . 0.0 111.18 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.534 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.7 169.72 13.14 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.035 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.748 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -124.64 117.75 24.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.63 0.252 . . . . 0.0 111.596 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.031 HD11 ' HB1' ' A' ' 139' ' ' ALA . 23.7 mt -85.95 91.99 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.957 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.46 146.02 7.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.874 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.608 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 45.8 p90 -150.04 125.2 10.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.701 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.77 113.53 24.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.798 0.332 . . . . 0.0 110.343 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 18' ' ' ARG . 12.6 ttp180 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.151 0 CA-C-O 120.92 0.391 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.5 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -105.76 148.03 10.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.329 0.585 . . . . 0.0 111.847 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.608 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 8.4 mt-10 -122.34 173.78 7.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.863 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 34.0 m-85 -138.55 133.56 32.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.63 0.252 . . . . 0.0 111.35 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.2 tp -76.8 133.21 39.46 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.584 HD22 ' HB3' ' A' ' 43' ' ' TRP . 5.4 mt -132.98 144.53 50.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.98 0.419 . . . . 0.0 111.019 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 112' ' ' LEU . 54.3 mt -123.13 116.54 23.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.478 HE21 ' HZ2' ' A' ' 43' ' ' TRP . 15.9 tt0 -74.55 132.35 41.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.184 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.04 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.8 p80 . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.785 0.326 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.584 ' HB3' HD22 ' A' ' 33' ' ' LEU . 72.6 m95 -108.27 123.09 48.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.4 p -147.11 151.28 40.72 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.741 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.504 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 41.7 Cg_endo -66.79 168.3 17.25 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.493 2.128 . . . . 0.0 111.86 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.556 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 36.1 Cg_exo -60.3 99.53 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.588 2.192 . . . . 0.0 112.775 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 4.4 pttt -106.83 140.1 40.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.683 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.36 178.42 16.76 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.628 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.71 94.22 5.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.791 0.329 . . . . 0.0 110.666 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.675 ' N ' HG21 ' A' ' 59' ' ' THR . 1.7 p -69.56 132.13 33.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.068 0.461 . . . . 0.0 111.031 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.539 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.3 tt0 -95.35 151.88 38.96 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.119 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.539 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.3 Cg_endo -49.38 -33.08 28.18 Favored 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.682 2.255 . . . . 0.0 112.585 -179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.521 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -90.4 -13.38 60.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.345 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -87.67 165.12 15.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.553 0.216 . . . . 0.0 110.528 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.899 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 33.8 t70 -82.79 161.34 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.078 0.466 . . . . 0.0 110.711 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.5 -63.62 1.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.689 HD21 HG21 ' A' ' 77' ' ' ILE . 15.5 tp -61.87 -40.12 94.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.491 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.899 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -50.81 -50.06 57.14 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.675 HG21 ' N ' ' A' ' 50' ' ' VAL . 86.7 m -54.88 -36.81 65.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.502 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -75.22 -32.09 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.043 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -72.03 -53.03 14.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.641 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 8.5 ttt-85 -59.02 -43.61 91.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.416 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.61 70.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.279 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.957 HG23 HD11 ' A' ' 15' ' ' ILE . 27.2 m -62.93 -53.78 48.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.328 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.499 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.4 pt20 -74.17 -23.05 59.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.726 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.47 -37.46 36.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -110.07 9.84 24.1 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.81 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.714 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -153.25 -14.55 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.536 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 80.2 -6.41 60.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.578 HG21 HD23 ' A' ' 75' ' ' LEU . 2.6 mt -98.03 127.41 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.8 pt-20 -107.5 170.3 8.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.867 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.62 -31.34 10.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.9 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.46 -21.03 79.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.184 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -97.38 -5.6 35.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.648 0.261 . . . . 0.0 111.069 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.867 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.03 -167.82 1.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.781 0.324 . . . . 0.0 110.292 179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -140.02 97.48 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.897 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.689 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -70.77 112.83 6.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.018 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.97 134.6 29.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -94.26 151.28 19.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.36 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.81 -21.98 40.14 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.524 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.819 ' CE1' HD21 ' A' ' 100' ' ' LEU . 18.9 t80 -106.29 126.55 52.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.798 0.333 . . . . 0.0 110.869 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.75 125.97 5.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.083 0.468 . . . . 0.0 111.55 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -152.45 136.47 16.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.905 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.995 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -118.74 143.9 46.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.082 0.468 . . . . 0.0 111.651 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.895 HD13 ' HB3' ' A' ' 135' ' ' GLU . 3.8 mt -100.47 124.73 46.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.137 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -114.95 120.17 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.021 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 9.0 p90 -167.07 144.83 4.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.122 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.9 p -83.99 109.0 16.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.78 -93.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.435 ' HG3' ' OD1' ' A' ' 91' ' ' ASN . 12.8 ptt85 -74.8 -48.17 26.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.857 0.36 . . . . 0.0 110.351 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.435 ' OD1' ' HG3' ' A' ' 90' ' ' ARG . 20.2 p-10 -171.47 30.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.669 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.779 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.37 125.58 2.65 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.557 179.62 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.845 ' O ' HD12 ' A' ' 8' ' ' LEU . 52.6 Cg_endo -68.08 117.79 5.17 Favored 'Trans proline' 0 CA--C 1.513 -0.571 0 C-N-CA 123.273 2.649 . . . . 0.0 112.816 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -101.5 124.35 47.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.741 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.7 m -90.53 112.04 23.57 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 32.5 t -109.06 108.96 26.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.642 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.995 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.68 142.89 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.504 ' CE1' ' HG2' ' A' ' 45' ' ' PRO . 7.7 m-85 -126.3 133.61 51.36 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.581 ' CH2' HG21 ' A' ' 97' ' ' ILE . 14.5 m-90 -124.07 143.34 50.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.444 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.819 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -80.96 128.53 33.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.224 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -134.43 142.17 47.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.178 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 10.9 tt0 -119.5 115.28 23.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.646 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.792 HG12 HD23 ' A' ' 75' ' ' LEU . 11.9 m -72.24 129.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 121.304 0.574 . . . . 0.0 110.653 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' CD ' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.69 -27.1 68.46 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.794 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.477 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 1.3 m-20 -106.35 132.77 52.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.111 0.481 . . . . 0.0 111.969 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -69.09 -43.25 74.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.458 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -100.21 24.02 9.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.811 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 2.9 p -41.89 147.22 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' CD ' ' A' ' 111' ' ' ARG . 0.4 OUTLIER -61.75 144.64 54.37 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.306 0.574 . . . . 0.0 110.768 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.907 HG21 ' CD1' ' A' ' 119' ' ' TYR . 30.5 mm -124.26 96.81 4.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.928 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.536 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 15.2 mtp180 -106.77 99.77 9.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.97 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 34' ' ' LEU . 8.3 mt -85.68 172.86 10.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.528 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.11 -172.72 2.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.847 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -60.13 -29.57 68.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.09 -6.98 52.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.779 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.457 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 52.9 m80 -142.05 127.88 19.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.0 110.995 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.26 -18.94 15.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.513 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.03 163.67 39.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 111.43 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.907 ' CD1' HG21 ' A' ' 110' ' ' ILE . 38.5 p90 -138.25 175.16 9.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.713 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.421 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 4.1 mtt85 -158.68 158.66 34.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 0.0 111.509 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CE2' HD13 ' A' ' 32' ' ' LEU . 87.5 m95 -127.1 106.74 9.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.62 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -138.15 167.62 21.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.066 0.46 . . . . 0.0 111.585 -178.716 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.74 -153.51 3.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.707 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.03 -46.69 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.843 0.322 . . . . 0.0 110.845 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.2 pt-20 -56.14 -49.34 74.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.9 -50.68 22.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.551 -179.503 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.38 -29.63 10.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 2.3 m -83.94 -33.94 24.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.392 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.29 -41.43 94.12 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.585 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.554 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -77.6 -44.33 28.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.88 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.88 52.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.142 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -37.8 -34.11 0.1 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.131 -179.377 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.4 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 21.2 m-85 -54.8 114.77 1.84 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.127 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -45.8 -50.81 13.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.519 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.895 ' HB3' HD13 ' A' ' 85' ' ' LEU . 11.3 mp0 -46.03 -46.97 16.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.624 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.583 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -71.36 -45.24 63.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.696 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.61 -30.24 12.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -79.77 -47.01 15.94 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.842 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 1.031 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.61 -47.47 63.6 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.032 0.444 . . . . 0.0 110.423 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.583 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -73.86 -27.67 61.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.024 178.99 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.553 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -67.19 -51.45 53.42 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.639 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -67.06 -30.74 70.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.55 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.5 -56.62 22.66 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.948 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -67.78 -28.26 67.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.771 0.319 . . . . 0.0 110.45 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -68.55 -43.71 76.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -72.67 -52.58 14.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.256 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.574 HD11 ' CE2' ' A' ' 16' ' ' PHE . 32.2 mt -52.23 -34.84 47.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.658 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.53 0.2 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.264 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.595 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.952 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -104.11 127.82 51.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.113 -179.719 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 121.83 25.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.024 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -138.74 160.52 39.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.827 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.9 m -148.19 123.66 10.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.237 0.541 . . . . 0.0 111.146 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.411 ' CA ' ' HB3' ' A' ' 47' ' ' LYS . . . -114.85 170.94 13.45 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.678 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.727 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -124.67 117.24 23.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.859 0.361 . . . . 0.0 110.798 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.863 HD11 ' HB1' ' A' ' 139' ' ' ALA . 62.8 mt -82.87 92.32 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.818 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.64 145.73 8.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.186 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.664 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 29.0 p90 -149.62 124.08 9.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.837 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.66 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -87.12 113.51 22.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.4 . . . . 0.0 110.654 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 18' ' ' ARG . 5.9 ttp85 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.917 0.389 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.664 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.0 mt -101.17 148.33 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.616 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 16.8 mp0 -134.86 134.27 40.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.725 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -96.35 150.04 21.03 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -82.97 135.93 34.71 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.098 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.54 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.2 mt -135.54 142.65 45.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.868 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.637 HD22 ' CD2' ' A' ' 112' ' ' LEU . 8.8 mt -123.29 113.63 19.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.08 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.9 tt0 -69.09 122.26 18.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.426 179.363 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 120.817 0.341 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 10.1 m95 -95.84 139.21 32.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.05 136.64 9.41 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.748 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 73.7 Cg_exo -49.17 169.08 0.11 Allowed 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.781 1.654 . . . . 0.0 111.018 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 1.5 Cg_endo -78.16 101.06 1.43 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.027 1.818 . . . . 0.0 112.141 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HB3' ' CA ' ' A' ' 12' ' ' GLY . 0.3 OUTLIER -120.88 -173.11 2.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.46 -139.41 2.67 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.352 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -131.57 127.23 36.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.554 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 0.2 OUTLIER -81.6 135.51 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-O 120.95 0.405 . . . . 0.0 110.599 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CG ' ' HB2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -87.18 170.43 12.1 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.004 -179.727 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 76.8 Cg_exo -49.68 -63.29 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.793 2.328 . . . . 0.0 112.87 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.9 19.27 42.77 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.432 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 30.5 tt0 -90.6 160.77 15.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.976 0.388 . . . . 0.0 110.754 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.906 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -85.31 162.69 18.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.057 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.532 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -72.13 -62.98 1.24 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.086 0.47 . . . . 0.0 110.737 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD21 HG21 ' A' ' 77' ' ' ILE . 21.9 tp -61.97 -42.53 99.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.316 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.906 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.2 mt-10 -50.35 -46.87 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.73 0.3 . . . . 0.0 110.516 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.554 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 87.6 m -54.63 -37.36 65.56 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.09 -32.74 50.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.122 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.2 mt -70.95 -53.46 14.84 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.73 -38.86 89.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.038 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.53 -33.79 76.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.045 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.818 HG23 HD11 ' A' ' 15' ' ' ILE . 90.0 m -58.55 -51.92 67.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.393 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.544 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.63 -20.96 61.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.919 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.67 -41.67 30.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.755 0.312 . . . . 0.0 111.17 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.555 ' O ' HD13 ' A' ' 34' ' ' LEU . 13.8 mt-10 -108.08 6.34 26.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.614 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 46' ' ' PRO . . . -148.24 -7.96 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.625 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 70.95 -1.94 20.87 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.143 -1.027 . . . . 0.0 113.241 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.741 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.4 mt -100.92 127.67 53.86 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.042 0 CA-C-N 117.035 0.418 . . . . 0.0 110.811 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.1 pm0 -108.32 166.6 10.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.12 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.71 -34.55 5.24 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.734 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.41 -23.78 77.24 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.292 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.527 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 2.9 mm-40 -93.72 -5.83 47.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.395 0.14 . . . . 0.0 111.233 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.42 -171.35 2.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.996 0.427 . . . . 0.0 110.64 178.775 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.8 m -138.98 99.02 3.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.591 HG13 HD21 ' A' ' 61' ' ' LEU . 7.6 mm -71.58 120.38 19.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.448 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.33 131.33 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.221 0.534 . . . . 0.0 110.937 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -90.59 148.81 22.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.211 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.72 -24.32 30.03 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.285 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CE1' HD21 ' A' ' 100' ' ' LEU . 17.0 t80 -103.71 125.62 50.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.691 0.282 . . . . 0.0 110.864 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HD2' ' HZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.09 123.59 4.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 111.414 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.5 tpt85 -152.34 138.16 18.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.683 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.951 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.3 OUTLIER -114.69 134.02 55.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.429 -179.691 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.679 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.2 mt -91.11 122.67 33.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.524 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -115.89 123.49 48.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.33 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -167.05 142.03 4.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.823 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.2 p -82.02 109.86 16.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.29 -98.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.007 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -38.3 84.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 176.79 27.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.076 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.809 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -158.82 130.67 4.09 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.478 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.884 ' O ' HD12 ' A' ' 8' ' ' LEU . 47.6 Cg_endo -66.46 120.46 7.59 Favored 'Trans proline' 0 CA--C 1.516 -0.392 0 C-N-CA 123.381 2.721 . . . . 0.0 113.024 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.952 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -101.31 123.21 45.05 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.794 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -95.73 109.0 21.36 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 t -108.41 108.82 26.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.977 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.951 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.14 125.29 40.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.56 ' HB3' HG13 ' A' ' 14' ' ' ILE . 32.7 m-85 -111.74 165.43 12.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.532 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 4.7 m-90 -152.68 138.56 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.292 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.696 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -75.84 124.92 28.11 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.524 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.565 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -131.49 143.71 50.61 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.357 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.0 tt0 -117.6 110.67 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.766 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.758 HG12 HD23 ' A' ' 75' ' ' LEU . 10.9 m -72.27 143.55 13.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.386 0.613 . . . . 0.0 111.589 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.533 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 3.8 mptp? -71.59 -12.53 61.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.885 -177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.561 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 6.5 t70 -133.35 127.61 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 111.931 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.66 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 59.7 t80 -62.54 -38.43 89.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -100.3 21.3 13.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.695 178.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -43.03 145.82 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.064 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.632 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -61.85 140.19 58.29 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.32 0.581 . . . . 0.0 110.621 -179.337 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.812 HG21 ' CG ' ' A' ' 119' ' ' TYR . 28.6 mm -123.74 95.2 3.2 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.879 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.625 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.1 mtp85 -95.3 102.32 14.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.158 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.637 ' CD2' HD22 ' A' ' 34' ' ' LEU . 11.4 mt -90.65 144.49 25.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.11 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -89.09 -156.27 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 7.0 11.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.449 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -99.12 -29.86 12.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.435 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.9 m80 -120.61 157.36 29.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.823 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -120.16 -21.4 7.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.694 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -154.59 178.6 9.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.914 0.388 . . . . 0.0 111.507 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.812 ' CG ' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -156.56 161.05 39.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.866 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.686 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -148.97 148.39 29.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.038 0.447 . . . . 0.0 111.383 179.588 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 81.2 m95 -105.96 106.9 17.62 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.3 169.71 17.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 0.0 111.666 -178.26 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.33 -151.83 3.93 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.763 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.54 -45.62 24.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.767 0.318 . . . . 0.0 111.351 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.47 -52.19 66.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.803 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.02 -46.7 67.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.558 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.54 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.54 -31.12 63.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.298 0.57 . . . . 0.0 109.763 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.4 m -82.57 -30.84 29.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.183 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.73 -43.55 88.7 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.725 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.636 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -77.73 -37.42 49.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.217 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.521 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.95 56.52 1.97 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.151 0.501 . . . . 0.0 110.085 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.438 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.57 -34.06 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.255 -179.464 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -59.5 115.32 3.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.185 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -46.17 -44.92 16.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.381 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.679 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.2 mp0 -49.31 -60.24 2.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.264 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.553 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -54.37 -40.23 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.921 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.416 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -53.41 -39.58 64.43 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.607 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.21 -44.39 30.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.378 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.19 -42.74 63.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.246 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -79.67 -29.52 40.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.015 178.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.607 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.3 OUTLIER -66.92 -52.24 45.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.823 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -66.22 -28.91 69.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.424 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.412 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.1 -53.67 42.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.833 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.61 ' NE2' HD12 ' A' ' 29' ' ' ILE . 18.0 t-80 -71.24 -30.23 66.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 0.0 110.106 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.82 -50.3 67.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.347 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -62.39 -52.08 65.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.738 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.448 ' CD2' HG12 ' A' ' 78' ' ' ILE . 67.6 mt -55.03 -30.18 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.5 t -83.02 -8.43 59.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.594 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.299 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.623 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.114 0.483 . . . . 0.0 111.37 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.62 142.18 41.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.524 179.644 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.7 mtt180 -78.56 137.77 38.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.639 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.655 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -149.56 162.61 39.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.599 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 16.6 m -156.42 123.5 5.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.17 0.51 . . . . 0.0 111.54 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.62 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -113.47 178.0 18.29 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.555 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.742 HD11 HD23 ' A' ' 61' ' ' LEU . 1.1 mt -135.1 118.2 16.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.047 0.424 . . . . 0.0 111.801 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.497 HG12 ' HB3' ' A' ' 98' ' ' TYR . 11.2 mm -75.67 90.9 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.837 HD11 HG23 ' A' ' 64' ' ' THR . 30.2 mt -84.97 136.65 22.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.711 -178.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.687 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.9 p90 -146.47 124.05 11.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.828 -178.191 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.736 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.47 113.21 18.49 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.008 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.424 -179.336 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.857 0.36 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.687 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 12.3 mt -102.88 147.71 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 111.485 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.4 mp0 -135.85 141.39 44.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.659 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.588 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 53.4 m-85 -103.37 149.71 24.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.927 0.394 . . . . 0.0 112.018 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 43.5 tp -84.02 136.64 33.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.3 mt -136.95 143.13 42.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.609 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 112' ' ' LEU . 19.9 mt -121.31 112.29 18.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.759 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.493 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 62.4 tt0 -60.68 134.22 56.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.315 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.626 179.528 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.524 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 45.6 m95 -115.69 112.61 22.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.959 0.409 . . . . 0.0 111.267 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -125.63 143.73 45.88 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.66 171.39 12.11 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.194 1.93 . . . . 0.0 111.97 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.432 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 25.2 Cg_endo -61.49 96.24 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.436 2.091 . . . . 0.0 112.109 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.687 ' O ' ' HB1' ' A' ' 63' ' ' ALA . 7.3 mttt -86.63 170.64 11.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -166.58 128.58 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.696 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.69 109.91 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.713 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -79.42 137.02 22.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.097 0.475 . . . . 0.0 111.15 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 4.1 tt0 -95.12 151.48 38.82 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.277 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 7.4 Cg_endo -52.57 -31.02 47.45 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.71 2.273 . . . . 0.0 112.88 -179.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -91.2 -13.38 58.86 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.508 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -87.24 161.44 18.0 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.53 0.205 . . . . 0.0 110.684 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 31.1 t70 -78.29 160.89 27.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.364 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 15.5 m-20 -71.6 -62.21 1.5 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.253 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.699 HD21 HG21 ' A' ' 77' ' ' ILE . 24.8 tp -62.32 -40.44 96.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.299 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -50.32 -45.01 54.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.733 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.543 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 90.2 m -60.06 -41.81 93.16 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.23 -31.3 69.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.785 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.904 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -73.5 -52.19 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.642 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -59.5 -44.09 93.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.57 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 47' ' ' LYS . . . -58.77 -37.1 75.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.046 0.45 . . . . 0.0 110.045 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.837 HG23 HD11 ' A' ' 15' ' ' ILE . 34.7 m -60.32 -54.02 50.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.562 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 10.7 pt20 -73.23 -21.7 60.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.915 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -79.32 -41.69 27.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.219 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 -106.1 2.58 27.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.722 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.59 -8.99 0.64 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.611 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 72.51 1.02 51.04 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.934 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.622 ' CG2' HD23 ' A' ' 75' ' ' LEU . 3.9 mt -103.7 122.23 56.12 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.7 pt-20 -107.24 168.55 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.441 -179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.904 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.18 -36.13 8.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.507 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.62 78.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.109 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 0.2 OUTLIER -91.52 -6.6 52.25 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.704 0.288 . . . . 0.0 111.06 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -135.9 -176.2 4.23 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.86 0.362 . . . . 0.0 110.24 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.538 ' H ' ' H ' ' A' ' 102' ' ' GLU . 94.7 m -124.63 103.24 8.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.726 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.699 HG21 HD21 ' A' ' 57' ' ' LEU . 14.2 mm -77.63 109.79 12.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.905 0.383 . . . . 0.0 111.569 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.768 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -72.42 138.3 21.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.701 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -94.27 148.84 21.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.468 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.87 -23.09 34.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.736 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CD1' HD21 ' A' ' 100' ' ' LEU . 34.4 t80 -100.71 125.25 47.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.38 . . . . 0.0 111.075 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.48 126.09 5.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.176 0.512 . . . . 0.0 111.273 179.693 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -153.81 137.44 16.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.202 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.919 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -118.08 134.6 54.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 0.0 111.35 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.784 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.1 mt -101.62 117.82 35.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.481 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.24 126.51 53.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.144 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -166.93 140.23 3.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.646 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.6 p -80.41 108.82 14.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.557 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.62 -95.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.587 -178.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.496 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -69.98 -39.15 76.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.72 0.295 . . . . 0.0 110.875 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 6.2 t-20 176.41 29.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.853 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.646 ' N ' HG23 ' A' ' 88' ' ' VAL . 0.0 OUTLIER -157.65 123.99 2.51 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.737 179.785 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.6 Cg_endo -73.43 117.63 5.16 Favored 'Trans proline' 0 CA--C 1.515 -0.436 0 C-N-CA 123.025 2.483 . . . . 0.0 112.832 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 2.1 mmmt -103.0 121.73 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.349 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.549 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 55.2 m -88.74 113.61 24.49 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.74 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.9 t -112.44 109.41 28.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.222 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.919 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -84.92 130.14 36.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.497 ' HB3' HG12 ' A' ' 14' ' ' ILE . 37.4 m-85 -115.62 137.7 51.81 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.605 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.8 m-90 -125.92 143.83 50.92 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.113 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.768 HD12 HG21 ' A' ' 78' ' ' ILE . 6.2 mt -75.5 123.84 26.15 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.514 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.547 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -131.98 144.16 50.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.423 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.538 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.7 tt0 -123.64 112.63 17.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.601 0.238 . . . . 0.0 111.111 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.736 HG22 ' HG2' ' A' ' 17' ' ' ARG . 3.4 m -72.81 112.77 9.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.751 0.786 . . . . 0.0 110.387 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -8.78 14.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.517 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.876 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 6.1 m-20 -112.43 107.04 15.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.942 0.401 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CD1' ' HD2' ' A' ' 17' ' ' ARG . 2.7 t80 -55.47 -39.78 70.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -101.09 26.18 7.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.69 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.876 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.5 p -47.9 146.47 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.347 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.423 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 5.9 pm0 -68.68 143.09 54.86 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.118 0.485 . . . . 0.0 110.542 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.833 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.2 mm -120.97 97.55 5.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.511 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.611 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 19.5 mtp180 -101.84 99.92 10.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.435 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 34' ' ' LEU . 3.1 mt -92.06 -172.6 3.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.822 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.7 t -125.97 -172.57 2.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.811 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -66.58 -25.01 66.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.329 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.75 -12.53 60.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.29 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.413 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 81.7 m-70 -124.26 105.94 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.792 0.33 . . . . 0.0 110.764 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.52 -17.0 60.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.876 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.24 -179.57 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.126 0.489 . . . . 0.0 111.703 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.833 ' CD1' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -145.65 171.89 14.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.717 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 64.9 mtt180 -157.94 153.25 25.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.244 0.545 . . . . 0.0 111.675 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.566 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 90.6 m95 -118.03 107.14 13.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.367 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.771 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -136.63 173.59 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.045 0.45 . . . . 0.0 111.684 -178.555 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -79.94 -153.24 8.25 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.798 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.46 -41.16 40.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.0 pt-20 -61.05 -51.93 67.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.749 0.309 . . . . 0.0 111.413 -179.445 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.771 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.36 -48.72 60.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.904 0.383 . . . . 0.0 110.227 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.55 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -53.94 -27.25 29.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.411 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -83.23 -32.89 26.24 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.952 178.539 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.722 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.76 -46.99 82.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.66 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.4 OUTLIER -78.3 -37.19 45.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.512 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -75.36 52.22 0.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.069 0.461 . . . . 0.0 110.813 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.76 -32.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.62 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -63.4 120.53 11.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.617 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.61 -49.41 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.006 0.431 . . . . 0.0 111.175 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.784 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.9 mp0 -47.25 -53.24 13.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.673 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.522 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -60.03 -43.0 95.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.186 -179.243 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.5 OUTLIER -53.29 -36.57 61.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.571 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.01 -42.43 32.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.255 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.881 179.088 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.55 HD22 ' HB1' ' A' ' 127' ' ' ALA . 1.2 mt -78.39 -27.52 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.984 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -69.19 -51.85 33.8 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.854 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.21 -30.04 67.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.393 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.57 -49.52 72.84 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.823 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.444 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 6.4 t-160 -76.25 -36.32 58.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.053 0.454 . . . . 0.0 110.273 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -61.02 -52.72 63.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.533 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.94 -50.56 72.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.016 0.436 . . . . 0.0 111.191 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.558 ' HG ' HD13 ' A' ' 100' ' ' LEU . 94.0 mt -56.88 -31.71 65.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.678 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.16 -4.18 54.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.797 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.795 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.647 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 121.037 0.446 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.988 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.4 139.9 43.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.043 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.796 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -83.92 123.71 30.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.993 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.45 163.52 30.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 6.4 m -157.75 124.04 4.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 111.146 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.581 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.53 170.13 13.27 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.488 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.611 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -123.55 117.91 26.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.854 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.5 mt -86.77 91.74 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.996 HD11 HG23 ' A' ' 64' ' ' THR . 52.7 mt -79.94 146.31 7.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.622 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.665 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 51.4 p90 -151.33 122.27 7.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.439 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.11 112.24 18.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.548 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.701 0.286 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.665 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.9 mt -129.02 140.43 49.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.453 . . . . 0.0 111.99 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -135.24 126.93 29.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.001 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.0 m-85 -89.7 150.46 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.673 HD23 HD12 ' A' ' 15' ' ' ILE . 44.0 tp -85.88 138.53 31.97 Favored 'General case' 0 CA--C 1.523 -0.059 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.866 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.5 mt -139.13 132.77 30.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.566 HD11 ' HG3' ' A' ' 46' ' ' PRO . 17.0 mt -108.92 100.2 9.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.93 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 41.1 tt0 -55.08 133.95 49.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.922 179.02 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 . . . . . 0 N--CA 1.456 -0.139 0 CA-C-O 120.944 0.402 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.563 ' CE2' HD22 ' A' ' 130' ' ' LEU . 5.9 m95 -101.63 128.5 47.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.49 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.438 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.2 OUTLIER -137.51 139.4 27.19 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.265 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 40.7 Cg_exo -56.87 164.34 6.22 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.244 1.962 . . . . 0.0 111.975 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.566 ' HG3' HD11 ' A' ' 34' ' ' LEU . 29.0 Cg_exo -60.34 83.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.528 0.186 0 C-N-CA 122.669 2.246 . . . . 0.0 112.314 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.48 153.09 19.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.038 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.4 -154.83 6.45 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.088 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -125.36 109.33 12.64 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.547 0.213 . . . . 0.0 110.912 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.796 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -83.21 132.59 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.543 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 2.6 tt0 -95.07 152.15 39.3 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.417 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.543 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.9 Cg_endo -49.26 -31.29 21.87 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.945 2.43 . . . . 0.0 112.831 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.535 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -94.97 -10.66 57.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.304 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -88.6 158.71 18.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.512 0.196 . . . . 0.0 110.589 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.852 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.2 t0 -76.78 160.34 29.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.012 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.92 -61.5 1.83 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.221 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.468 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.6 tp -61.39 -42.14 98.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.747 0.308 . . . . 0.0 111.076 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.852 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.26 -46.7 55.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.373 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.609 HG21 ' N ' ' A' ' 50' ' ' VAL . 89.2 m -55.66 -42.32 74.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.33 -32.7 68.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.059 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.922 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -71.19 -52.97 16.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.603 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 mtt180 -58.09 -39.28 78.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.748 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.6 -30.39 71.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.114 0.483 . . . . 0.0 109.945 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.996 HG23 HD11 ' A' ' 15' ' ' ILE . 18.5 m -65.04 -50.94 64.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.64 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.57 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.5 pp0? -76.05 -24.85 55.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.933 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -79.04 -37.56 38.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.902 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -104.27 -8.81 19.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.911 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.42 -3.25 1.73 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.79 0.24 32.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.619 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.618 HG21 HD23 ' A' ' 75' ' ' LEU . 2.3 mt -103.95 123.99 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.81 167.12 10.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.922 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -48.53 -27.62 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.251 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.29 -21.03 76.44 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.227 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HG2' HG23 ' A' ' 70' ' ' ILE . 1.2 tp60 -98.06 -9.39 26.03 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.793 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -126.03 -171.23 2.34 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.097 0.475 . . . . 0.0 110.514 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 83.9 m -133.85 100.67 4.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.385 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 101' ' ' ALA . 8.1 mm -74.14 118.38 19.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.517 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.74 132.83 30.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -91.04 148.57 22.3 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.122 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.1 -26.8 19.44 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.588 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.481 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.6 t80 -103.49 124.26 48.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.0 111.038 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 127.93 6.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.196 179.606 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.89 142.68 17.74 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.169 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.946 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.2 pm0 -120.87 141.4 50.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.105 0.479 . . . . 0.0 111.816 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.867 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -101.36 118.73 37.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.078 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -111.42 124.44 52.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.144 0.497 . . . . 0.0 111.038 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.442 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 25.6 p90 -167.08 145.86 5.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.823 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.61 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.4 p -85.62 111.86 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.764 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.43 -106.34 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.278 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -39.61 93.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.858 0.361 . . . . 0.0 110.555 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.4 t30 178.25 30.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.968 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.776 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -156.45 125.4 3.03 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.826 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.3 116.49 4.64 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 123.206 2.604 . . . . 0.0 112.825 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.988 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -99.95 128.39 46.05 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.699 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.6 m -95.59 104.95 16.89 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 177.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.653 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 36.2 t -104.05 108.43 24.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.966 -178.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.946 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.38 136.62 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.466 ' CZ ' HG11 ' A' ' 96' ' ' VAL . 37.2 m-85 -123.49 129.86 51.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.473 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 3.8 m-90 -115.03 148.88 38.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.026 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.523 HD13 ' HG ' ' A' ' 147' ' ' LEU . 6.6 mt -83.29 127.47 33.68 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.61 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.97 144.6 48.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.627 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.432 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -123.31 116.74 23.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.793 0.33 . . . . 0.0 111.396 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.751 HG12 HD23 ' A' ' 75' ' ' LEU . 4.8 m -76.93 121.04 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 121.447 0.642 . . . . 0.0 110.833 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.407 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.99 -22.24 66.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.522 -179.26 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.784 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 4.6 m-20 -104.94 119.83 39.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.987 0.422 . . . . 0.0 111.712 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -43.88 95.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.168 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -96.22 21.26 9.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.079 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.784 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -42.26 145.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.367 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.707 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -62.03 141.2 58.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.318 0.58 . . . . 0.0 111.3 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.925 HG21 ' CD2' ' A' ' 119' ' ' TYR . 35.4 mm -123.99 100.48 7.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.707 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -99.67 101.61 12.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.416 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.512 HD11 ' HD2' ' A' ' 119' ' ' TYR . 17.3 mt -92.75 163.87 13.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.43 -168.9 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -64.46 -18.53 64.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.347 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.93 -18.25 35.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.688 0.28 . . . . 0.0 111.17 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 36.9 m80 -120.02 136.78 54.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.535 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -109.74 -19.17 13.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.533 -179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.52 166.25 16.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.869 0.366 . . . . 0.0 111.198 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.925 ' CD2' HG21 ' A' ' 110' ' ' ILE . 43.0 p90 -139.74 173.59 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.841 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.461 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 26.4 mtt-85 -160.68 158.33 28.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 0.0 111.486 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.462 ' CE2' HD13 ' A' ' 32' ' ' LEU . 86.3 m95 -122.09 107.4 12.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.28 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.67 172.7 12.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.065 0.46 . . . . 0.0 111.833 -178.198 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.0 -151.47 6.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.233 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.9 tp -77.3 -46.05 24.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.574 0.226 . . . . 0.0 111.539 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.7 pt-20 -58.18 -51.43 69.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.496 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -67.55 -54.1 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.069 0.461 . . . . 0.0 110.242 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -49.87 -31.11 11.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 0.0 110.157 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.7 m -83.86 -30.79 26.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.736 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -63.87 -43.4 96.18 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.788 -179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.563 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -77.66 -42.55 34.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.184 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.79 54.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 0.0 110.165 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.67 -33.9 0.09 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.302 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -59.59 120.54 9.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.676 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.38 -54.71 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.246 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.867 ' HB3' HD13 ' A' ' 85' ' ' LEU . 21.4 mp0 -41.67 -54.74 3.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.143 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.616 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.01 -44.64 95.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.206 -179.203 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.03 -42.58 49.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.384 . . . . 0.0 109.994 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.45 -45.04 73.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.76 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.854 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.16 -42.62 66.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -81.81 -29.2 32.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.319 179.345 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 124' ' ' LEU . 1.7 mm-40 -62.71 -51.62 66.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.904 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.84 -29.24 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.483 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.08 72.3 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.215 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 59.4 t-80 -80.41 -29.48 37.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.63 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -67.01 -52.63 40.18 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.243 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -63.3 -49.29 74.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.523 ' HG ' HD13 ' A' ' 100' ' ' LEU . 78.7 mt -57.26 -32.93 67.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.838 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -70.32 -16.64 63.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.8 0.333 . . . . 0.0 110.946 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.232 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.513 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.597 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 121.065 0.46 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -106.69 125.83 51.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.539 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' CD2' ' A' ' 49' ' ' HIS . 0.3 OUTLIER -79.09 115.58 18.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.099 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' ' O ' ' A' ' 95' ' ' THR . . . -126.78 160.65 30.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.481 ' SG ' HG11 ' A' ' 50' ' ' VAL . 87.4 m -152.01 123.49 7.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.696 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.615 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -114.69 177.59 17.56 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.016 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.68 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -127.55 117.42 22.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.704 0.288 . . . . 0.0 111.44 -179.69 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.864 HD11 ' HB1' ' A' ' 139' ' ' ALA . 73.4 mt -83.95 91.37 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 17.3 mt -79.23 145.22 9.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.238 -178.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.609 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.8 p90 -148.37 121.95 9.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.849 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 121' ' ' TRP . 3.9 ttp180 -85.95 112.75 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.001 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 121.071 0.463 . . . . 0.0 111.439 -179.492 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.768 0.318 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.609 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.5 mt -112.31 141.8 26.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 0.0 112.02 -179.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -128.18 136.08 50.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.098 179.593 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.564 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 50.5 m-85 -95.66 154.37 17.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.637 HD23 ' CD1' ' A' ' 15' ' ' ILE . 56.2 tp -86.93 134.41 33.51 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.496 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.2 mt -135.94 140.23 43.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 112' ' ' LEU . 43.3 mt -115.64 127.42 55.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.454 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -65.93 157.47 30.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.174 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.721 -179.666 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 16.7 p80 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.912 0.386 . . . . 0.0 110.598 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.5 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 41.7 m95 -101.68 129.97 47.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.3 p -149.06 143.97 17.57 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -56.16 159.61 12.25 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.313 2.009 . . . . 0.0 112.034 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.592 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 42.9 Cg_exo -57.83 88.9 0.05 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.684 2.256 . . . . 0.0 112.321 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.1 OUTLIER -104.64 156.21 18.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 111.319 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.45 -152.85 6.74 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.451 ' CD2' ' O ' ' A' ' 9' ' ' ARG . 9.8 t-80 -135.54 106.08 6.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.585 ' N ' HG21 ' A' ' 59' ' ' THR . 1.5 p -78.64 129.45 37.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 121.146 0.498 . . . . 0.0 111.472 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.583 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.2 tt0 -91.21 153.54 44.64 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.148 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.8 Cg_endo -44.0 -38.46 10.35 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.108 2.538 . . . . 0.0 113.004 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.583 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.93 -4.16 63.49 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.982 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -91.32 154.6 19.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.723 0.261 . . . . 0.0 110.856 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 17.3 t70 -73.03 158.45 35.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.995 0.426 . . . . 0.0 110.104 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -74.58 -65.38 0.87 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.809 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.737 HD21 HG21 ' A' ' 77' ' ' ILE . 20.2 tp -59.71 -37.65 79.45 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.704 0.287 . . . . 0.0 110.754 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.1 mt-10 -50.27 -50.03 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.379 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.585 HG21 ' N ' ' A' ' 50' ' ' VAL . 20.7 m -54.7 -42.5 71.55 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -70.52 -32.33 69.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.887 178.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.89 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.0 mt -71.04 -52.31 20.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.312 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -61.77 -42.81 99.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.464 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' ' 66' ' ' GLU . . . -60.36 -33.06 71.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.236 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 97.6 m -63.73 -49.28 73.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.36 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.563 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 12.3 pt20 -80.32 -23.26 40.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.716 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.419 ' HB3' ' HA ' ' A' ' 63' ' ' ALA . 22.5 tp10 -79.0 -31.8 44.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -111.63 -14.6 13.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.625 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -130.69 -5.35 4.1 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.486 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.95 1.83 49.59 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.026 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.772 ' O ' HG22 ' A' ' 64' ' ' THR . 2.9 mt -104.11 125.33 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 CA-C-O 120.918 0.389 . . . . 0.0 110.619 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.1 pt-20 -105.69 168.38 9.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.89 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.47 -36.36 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.762 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.83 -22.44 76.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.99 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.487 ' HB3' HG23 ' A' ' 70' ' ' ILE . 3.4 mm-40 -93.21 -5.08 50.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.607 0.241 . . . . 0.0 111.191 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.864 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.21 -166.16 1.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.784 0.326 . . . . 0.0 110.376 178.764 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 90.3 m -139.33 97.85 3.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.513 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.737 HG21 HD21 ' A' ' 57' ' ' LEU . 11.1 mm -71.42 106.33 2.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.212 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.777 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.37 133.35 32.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.596 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.53 151.14 20.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.251 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -21.51 40.36 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.884 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.481 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 19.9 t80 -105.36 127.78 53.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.791 0.329 . . . . 0.0 111.496 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.425 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 6.7 ttpt -158.52 128.06 5.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.525 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.79 147.68 25.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.722 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.8 OUTLIER -128.27 138.04 52.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.189 0.518 . . . . 0.0 111.951 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.892 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.6 mt -99.45 124.75 44.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.122 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.488 ' ND2' ' OG1' ' A' ' 95' ' ' THR . 4.3 m120 -114.21 124.76 52.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.32 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -167.49 146.87 5.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.097 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.63 HG23 ' CA ' ' A' ' 92' ' ' LYS . 11.0 p -89.55 107.68 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.721 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -74.91 -101.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.563 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 90' ' ' ARG . 0.1 OUTLIER -60.47 -49.43 77.59 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-O 120.91 0.386 . . . . 0.0 110.579 -179.956 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.07 27.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.187 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.843 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.59 131.43 5.94 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 120.931 0.396 . . . . 0.0 110.635 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.89 ' O ' HD12 ' A' ' 8' ' ' LEU . 57.9 Cg_endo -69.33 120.0 6.9 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.56 2.84 . . . . 0.0 112.869 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.836 ' HG2' HD13 ' A' ' 8' ' ' LEU . 18.3 mtpp -105.05 128.29 53.26 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.098 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.488 ' OG1' ' ND2' ' A' ' 86' ' ' ASN . 41.4 m -95.5 109.12 21.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.5 t -106.82 108.51 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.73 128.27 39.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.595 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.8 m-85 -116.63 131.45 56.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -177.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.542 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.3 m-90 -116.36 155.86 27.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.248 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.777 HD12 HG21 ' A' ' 78' ' ' ILE . 2.6 mt -89.83 124.42 34.65 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.08 137.1 46.26 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.75 0.309 . . . . 0.0 110.812 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CE1' ' A' ' 16' ' ' PHE . 13.8 tt0 -113.4 114.53 26.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.572 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.796 HG12 HD23 ' A' ' 75' ' ' LEU . 8.3 m -72.75 101.22 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 121.427 0.632 . . . . 0.0 110.311 179.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.423 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -56.83 -9.64 0.85 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.417 -178.653 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.854 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 9.8 m-20 -108.41 100.87 10.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.933 0.396 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.27 -38.81 59.29 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.992 0.425 . . . . 0.0 110.574 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.58 26.9 5.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.708 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.854 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.7 p -51.5 144.48 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.293 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -70.71 143.88 51.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.999 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 119' ' ' TYR . 35.9 mm -121.7 98.97 6.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.486 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.04 103.14 15.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.85 -179.307 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.5 mt -91.81 173.18 8.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.03 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.9 p -117.15 -172.22 2.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -66.82 -12.49 59.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.668 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -90.7 -23.37 20.74 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.599 0.237 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 71.0 m-70 -113.93 118.92 35.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.933 0.397 . . . . 0.0 110.878 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -85.35 -22.32 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.382 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.33 -177.14 3.93 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.927 0.394 . . . . 0.0 111.497 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.8 ' CD1' HG21 ' A' ' 110' ' ' ILE . 44.5 p90 -148.96 174.4 12.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.439 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 7.3 mtt180 -157.07 149.54 23.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.267 0.556 . . . . 0.0 111.851 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 94.6 m95 -112.78 106.83 15.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.325 178.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.29 167.61 21.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.1 0.476 . . . . 0.0 111.677 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.8 -165.55 28.94 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.912 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.4 tp -64.54 -43.29 94.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.99 -53.8 54.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.51 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.741 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.48 -48.28 56.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.937 0.399 . . . . 0.0 110.1 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.453 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -52.81 -26.93 15.99 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.444 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.8 OUTLIER -82.97 -38.58 22.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.804 178.571 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.741 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -58.33 -45.2 88.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.844 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.631 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -78.71 -38.42 39.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.289 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.451 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.23 50.19 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.713 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.43 -32.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -59.9 119.69 8.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.773 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -46.48 -50.16 17.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.569 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.892 ' HB3' HD13 ' A' ' 85' ' ' LEU . 35.6 mp0 -48.25 -54.76 12.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.139 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.622 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.17 -44.0 97.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.752 0.31 . . . . 0.0 110.934 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.444 ' HG2' ' SG ' ' A' ' 128' ' ' CYS . 0.0 OUTLIER -49.12 -39.28 27.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.158 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.7 -47.05 50.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.599 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.864 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.59 -46.72 67.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.322 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.441 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -75.45 -27.62 58.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.115 178.833 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -65.95 -51.8 55.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.209 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.481 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -73.79 -29.68 62.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.481 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.54 -50.32 66.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.757 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -70.25 -37.61 74.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.097 0.475 . . . . 0.0 110.077 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 45.9 tp60 -59.77 -52.49 65.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.245 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -55.08 -55.41 31.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.926 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.429 ' CD2' HG12 ' A' ' 78' ' ' ILE . 87.6 mt -58.56 -41.22 85.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.08 -12.96 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.691 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.14 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 121.098 0.475 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -108.66 137.26 46.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.751 179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.486 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -81.84 129.72 34.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.828 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.614 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -142.09 164.07 31.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.258 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 28.1 m -153.49 123.67 7.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.407 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.51 173.93 15.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.861 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.723 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.8 OUTLIER -127.89 117.89 22.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.959 0.38 . . . . 0.0 111.336 -179.895 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.898 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.8 mt -84.73 91.7 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.93 HD11 HG23 ' A' ' 64' ' ' THR . 52.4 mt -81.99 145.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.33 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.656 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 42.9 p90 -148.98 121.41 8.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.776 -179.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.407 ' HD3' ' C ' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -84.59 113.81 21.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.03 0.443 . . . . 0.0 110.688 179.501 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.025 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.115 0 CA-C-O 120.962 0.411 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.656 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.7 mt -87.29 154.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.569 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.3 mt-10 -135.63 125.06 24.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.508 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 52.0 m-85 -91.15 145.28 24.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.55 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.691 HD23 HD12 ' A' ' 15' ' ' ILE . 55.4 tp -85.09 138.93 32.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.05 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 34' ' ' LEU . 3.4 mt -139.11 144.21 38.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 112' ' ' LEU . 24.3 mt -122.69 107.23 11.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.752 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.543 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.3 tt0 -64.45 136.75 57.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.002 0.429 . . . . 0.0 111.314 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.819 179.519 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.903 0.383 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.543 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 30.1 m95 -113.15 142.86 45.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.248 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.8 OUTLIER -158.86 138.54 8.56 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 170.41 2.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.547 2.164 . . . . 0.0 112.055 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.572 ' HG3' HD11 ' A' ' 34' ' ' LEU . 31.8 Cg_exo -58.81 99.79 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.58 2.186 . . . . 0.0 112.517 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HD3' HG21 ' A' ' 96' ' ' VAL . 0.2 OUTLIER -94.12 148.94 21.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.611 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.475 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -131.16 178.76 17.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.839 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.553 ' CD2' ' N ' ' A' ' 49' ' ' HIS . 2.5 m-70 -121.17 90.69 3.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.663 0.268 . . . . 0.0 110.728 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.834 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -71.26 132.99 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.007 0.432 . . . . 0.0 111.04 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.534 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.4 tt0 -96.8 151.72 38.01 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.854 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 2.6 Cg_endo -47.84 -30.32 13.06 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.864 2.376 . . . . 0.0 112.704 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.528 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -96.74 -9.7 56.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.525 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -87.65 162.17 17.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.492 0.187 . . . . 0.0 110.632 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.861 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 11.8 t70 -78.45 161.35 27.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.997 0.427 . . . . 0.0 110.346 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.404 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 34.9 m-20 -74.24 -64.7 0.96 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.415 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.569 HD21 HG21 ' A' ' 77' ' ' ILE . 10.6 tp -61.52 -40.14 93.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.226 -179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.861 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.92 -50.08 58.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.61 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.834 HG21 ' N ' ' A' ' 50' ' ' VAL . 99.5 m -55.34 -39.19 69.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.861 0.362 . . . . 0.0 110.144 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.77 -38.86 67.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.685 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.875 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.9 mt -64.48 -52.91 55.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.518 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -43.78 97.42 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.47 -33.7 71.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.019 0.438 . . . . 0.0 110.156 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.93 HG23 HD11 ' A' ' 15' ' ' ILE . 23.8 m -60.53 -51.02 71.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.276 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.533 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 8.2 pt20 -77.76 -25.11 48.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.048 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -76.52 -32.66 58.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.08 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.449 ' O ' HD13 ' A' ' 34' ' ' LEU . 2.9 mt-10 -114.92 -0.18 13.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.868 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.04 -8.54 0.7 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.49 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 74.12 -1.32 49.2 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.183 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.646 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.0 mt -103.06 126.1 57.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 117.034 0.417 . . . . 0.0 111.231 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.3 pt-20 -109.92 169.35 8.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.0 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.875 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.5 -36.81 24.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.356 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.53 -15.63 68.62 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.394 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.437 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 1.5 tp-100 -101.48 -11.85 19.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.638 0.256 . . . . 0.0 111.299 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.18 -171.5 2.43 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 121.021 0.438 . . . . 0.0 110.512 179.261 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.452 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 88.2 m -132.6 99.77 4.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.664 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.569 HG21 HD21 ' A' ' 57' ' ' LEU . 10.0 mm -71.63 120.52 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.191 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.566 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.66 136.51 23.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -94.82 150.62 20.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.227 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.42 -18.5 55.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.867 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.838 ' CD1' HD21 ' A' ' 100' ' ' LEU . 14.3 t80 -109.74 128.06 55.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.874 0.368 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 130.93 7.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -153.57 140.7 19.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.56 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.973 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.2 pm0 -119.46 124.23 46.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.786 0.327 . . . . 0.0 111.08 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.59 HD13 ' CB ' ' A' ' 135' ' ' GLU . 7.3 mt -91.15 125.31 35.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.522 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -118.03 121.42 40.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.487 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.41 ' CD2' ' OE2' ' A' ' 135' ' ' GLU . 22.9 p90 -167.11 142.66 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.81 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.562 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -77.63 112.56 15.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.398 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.53 -98.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.528 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -43.23 98.26 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.915 0.388 . . . . 0.0 110.637 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.08 31.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.789 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -163.42 129.54 2.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.344 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.878 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.9 Cg_endo -66.81 119.41 6.43 Favored 'Trans proline' 0 CA--C 1.514 -0.523 0 C-N-CA 123.328 2.686 . . . . 0.0 112.912 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -103.5 120.75 41.46 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.974 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.9 m -85.59 106.43 16.89 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 t -105.11 108.58 25.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.102 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.973 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.49 129.03 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.519 ' HB3' HG13 ' A' ' 14' ' ' ILE . 44.5 m-85 -117.61 158.34 24.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.431 0.634 . . . . 0.0 112.682 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.47 ' CH2' HG21 ' A' ' 97' ' ' ILE . 8.4 m-90 -143.73 150.61 38.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.889 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -86.22 121.33 28.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -129.81 147.19 51.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.122 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.519 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.9 OUTLIER -121.81 116.17 23.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.205 -179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 HD23 ' A' ' 75' ' ' LEU . 10.0 m -76.02 116.27 18.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.302 0.572 . . . . 0.0 110.989 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -24.98 63.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.725 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.805 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 22.1 m-20 -99.29 112.76 24.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.142 0.496 . . . . 0.0 111.418 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -57.46 -45.64 84.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.181 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.26 25.19 5.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.861 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.805 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 3.2 p -43.92 145.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.004 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -66.35 142.1 57.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.294 0.568 . . . . 0.0 110.998 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.6 mm -121.75 98.15 5.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.49 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.9 OUTLIER -101.16 101.83 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.999 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 34' ' ' LEU . 12.8 mt -87.9 173.15 9.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.159 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.3 -167.07 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.989 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -68.68 -14.07 62.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.403 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.03 -17.87 31.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.692 0.282 . . . . 0.0 111.427 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.452 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 90.2 m-70 -130.17 129.63 43.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.785 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.87 -21.26 18.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.701 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.78 -177.66 6.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.989 0.424 . . . . 0.0 111.643 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.1 p90 -156.46 169.19 25.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.468 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -160.86 154.64 22.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 111.569 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -111.12 107.44 16.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.632 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -134.12 168.35 19.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.378 -178.553 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.16 -152.53 5.91 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.946 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.435 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.1 tp -77.11 -45.8 25.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.853 0.327 . . . . 0.0 111.334 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -58.04 -48.97 78.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.593 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.797 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.46 -48.98 36.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.881 0.372 . . . . 0.0 110.514 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.452 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.15 -30.11 35.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.326 0.584 . . . . 0.0 109.772 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.65 -32.79 25.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.408 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.797 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.0 -42.13 97.27 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.461 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.611 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -78.28 -41.67 33.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.359 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.7 55.97 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.726 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.406 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.32 -33.14 0.09 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -57.69 113.36 1.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.59 -41.2 14.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.392 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.59 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.6 mp0 -55.01 -51.53 65.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.185 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -62.85 -44.79 95.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -49.67 -39.51 36.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.965 0.412 . . . . 0.0 109.915 179.231 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.591 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.43 -45.55 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.543 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.898 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.77 -44.32 63.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.173 0.511 . . . . 0.0 110.215 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.04 -28.18 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.224 179.194 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.591 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -66.04 -51.99 53.14 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.81 -29.98 68.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.409 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.21 -57.02 21.26 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.807 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.458 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.7 t-160 -67.87 -33.1 74.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.762 0.315 . . . . 0.0 110.262 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -63.02 -52.55 62.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.33 -47.68 78.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.458 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.45 ' HG ' HD13 ' A' ' 100' ' ' LEU . 45.1 mt -57.31 -28.72 63.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.443 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -80.38 -14.16 58.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.931 0.396 . . . . 0.0 110.425 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 N--CA 1.454 -0.228 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.283 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 121.299 0.571 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.948 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.66 140.18 39.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.453 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.696 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.82 131.69 35.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.132 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.61 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -144.26 165.09 28.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.597 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 18.7 m -155.88 123.59 5.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.183 0.516 . . . . 0.0 111.418 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.55 175.45 16.15 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.586 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.694 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.0 OUTLIER -130.92 117.53 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.153 0.476 . . . . 0.0 111.518 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.97 HD11 ' HB1' ' A' ' 139' ' ' ALA . 44.9 mt -84.33 91.27 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.948 HD11 HG23 ' A' ' 64' ' ' THR . 21.2 mt -79.01 146.11 8.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.856 -1.065 . . . . 0.0 111.686 -177.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.754 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.2 p90 -152.48 122.9 7.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.568 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.77 113.76 19.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.647 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' CB ' ' HG3' ' A' ' 102' ' ' GLU . 22.8 ttm180 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.313 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 120.7 0.286 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.754 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.6 mt -102.47 151.03 6.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.116 0.484 . . . . 0.0 111.943 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 2.3 mt-10 -137.76 129.57 28.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.821 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.603 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.2 m-85 -91.91 148.86 21.89 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 ' CD1' ' A' ' 15' ' ' ILE . 46.4 tp -85.15 137.08 33.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.925 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.6 mt -137.13 138.31 40.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.368 . . . . 0.0 111.057 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 46' ' ' PRO . 11.1 mt -118.21 119.08 33.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.642 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.468 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.7 tt0 -82.48 133.84 35.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.538 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.382 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.923 0.392 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.533 ' CG ' ' HB3' ' A' ' 130' ' ' LEU . 78.1 m95 -104.32 131.8 51.25 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.936 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.762 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -158.07 156.31 27.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.959 -179.791 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.8 176.89 9.42 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.378 2.052 . . . . 0.0 111.984 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 34' ' ' LEU . 39.2 Cg_exo -60.58 114.58 2.2 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.542 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -103.61 142.35 34.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.047 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -132.62 172.52 21.23 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.235 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -120.9 95.13 4.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.814 0.34 . . . . 0.0 111.122 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.738 ' N ' HG21 ' A' ' 59' ' ' THR . 1.9 p -70.1 132.25 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.694 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.5 tt0 -96.98 152.4 38.32 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.85 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.1 Cg_endo -45.12 -33.99 8.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.018 2.479 . . . . 0.0 112.866 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.694 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.37 -10.42 59.41 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.594 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -86.45 168.0 14.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.608 0.242 . . . . 0.0 110.795 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.853 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.5 t70 -85.95 161.37 19.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 110.698 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.458 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -73.67 -65.67 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.867 -179.389 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.77 HD21 HG21 ' A' ' 77' ' ' ILE . 22.2 tp -62.28 -38.94 91.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.307 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.88 -50.17 57.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.468 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.738 HG21 ' N ' ' A' ' 50' ' ' VAL . 61.4 m -54.64 -38.98 67.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -74.07 -31.11 62.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.043 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.893 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.5 mt -74.18 -53.04 10.67 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.882 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -60.36 -42.96 96.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.542 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -33.82 71.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 0.0 110.038 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.948 HG23 HD11 ' A' ' 15' ' ' ILE . 32.7 m -62.45 -54.24 43.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.586 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.574 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -71.56 -21.16 61.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.165 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.61 -42.64 24.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.743 0.306 . . . . 0.0 111.017 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -105.49 6.16 32.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.637 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.61 -8.59 0.37 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.461 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 70.88 0.92 36.44 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.233 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.574 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -104.23 121.43 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-O 120.968 0.414 . . . . 0.0 110.778 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.3 pm0 -104.89 169.35 8.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.893 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -52.54 -26.78 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 110.705 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.413 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -75.05 -11.1 84.16 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.108 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.428 ' HG2' HG23 ' A' ' 70' ' ' ILE . 70.0 tp60 -110.58 -16.07 13.73 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.455 0.169 . . . . 0.0 111.102 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -119.55 -170.17 1.89 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.935 0.397 . . . . 0.0 110.512 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.514 ' H ' ' H ' ' A' ' 102' ' ' GLU . 60.4 m -136.36 102.13 4.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.172 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.77 HG21 HD21 ' A' ' 57' ' ' LEU . 9.7 mm -74.11 124.31 31.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.286 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.495 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.95 136.04 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.281 0.562 . . . . 0.0 111.273 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -96.31 147.83 23.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.61 -29.59 11.17 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.888 ' CD1' HD21 ' A' ' 100' ' ' LEU . 20.0 t80 -102.95 129.79 49.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.76 0.314 . . . . 0.0 110.886 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.56 129.05 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.413 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -149.15 136.01 19.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.133 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.953 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.0 pm0 -122.31 127.79 50.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.952 0.406 . . . . 0.0 111.24 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.017 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.1 mt -91.84 120.66 32.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.499 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -109.84 124.47 51.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.597 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 23.5 p90 -166.83 144.3 4.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.814 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.611 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.7 p -85.15 108.88 17.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.909 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.94 -97.93 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.158 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -62.28 -50.09 73.06 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.861 0.363 . . . . 0.0 110.682 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -175.1 29.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.244 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.727 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -161.69 130.45 3.03 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.515 179.47 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.841 ' O ' HD12 ' A' ' 8' ' ' LEU . 51.3 Cg_endo -68.32 117.8 5.2 Favored 'Trans proline' 0 CA--C 1.518 -0.313 0 C-N-CA 123.204 2.603 . . . . 0.0 112.789 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.948 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -100.98 117.35 34.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.86 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 54.7 m -80.75 112.54 18.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 177.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.6 t -110.47 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.656 -178.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.953 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.0 130.24 36.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.57 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.5 m-85 -115.52 128.81 56.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.025 0.441 . . . . 0.0 112.089 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CD2' HD13 ' A' ' 57' ' ' LEU . 4.2 m-90 -116.36 146.82 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.097 178.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.888 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -83.46 113.97 21.14 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.36 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.58 147.01 46.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.916 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.565 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tm-20 -123.0 115.45 21.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.337 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.764 HG12 HD23 ' A' ' 75' ' ' LEU . 10.7 m -73.27 122.99 27.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.243 0.544 . . . . 0.0 110.499 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 2.5 mttt -59.94 -26.31 65.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.847 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.674 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 54.1 t0 -105.81 125.69 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 111.828 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -41.09 99.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.283 0.563 . . . . 0.0 109.645 179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -100.03 24.13 8.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.541 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.674 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 3.5 p -40.93 152.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.215 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.712 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 3.0 pm0 -62.16 139.81 58.45 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.331 0.586 . . . . 0.0 111.161 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.893 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.6 mm -124.52 96.95 4.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.705 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.712 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -101.6 99.67 9.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.436 -178.702 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.679 HD11 ' HD1' ' A' ' 119' ' ' TYR . 12.9 mt -92.82 161.18 14.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.912 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -113.57 -169.24 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.389 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -65.99 -13.96 60.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.225 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -84.97 -18.97 32.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.038 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -134.3 109.65 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.726 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -88.99 2.13 54.45 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.0 160.61 6.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.062 0.458 . . . . 0.0 111.673 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.893 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.2 p90 -140.13 173.02 11.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.51 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.635 ' NH1' HD21 ' A' ' 130' ' ' LEU . 28.4 mtp180 -157.14 156.31 32.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.217 0.532 . . . . 0.0 111.967 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.456 ' CE2' HD13 ' A' ' 32' ' ' LEU . 92.3 m95 -122.35 107.13 11.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.471 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -139.33 172.15 13.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.064 0.459 . . . . 0.0 111.794 -178.322 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.82 -154.5 7.93 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.956 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.5 tp -76.39 -41.83 46.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.745 0.307 . . . . 0.0 111.291 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.9 pt-20 -61.21 -50.3 73.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.404 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.847 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.29 -42.67 65.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.715 -179.564 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.518 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -59.58 -30.6 68.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.9 m -82.45 -35.75 27.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.847 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -61.37 -43.17 99.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.78 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.635 HD21 ' NH1' ' A' ' 120' ' ' ARG . 1.5 mt -77.6 -44.7 27.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.002 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.99 56.1 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.017 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -38.91 -34.92 0.17 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.186 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.454 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 9.8 m-85 -53.36 114.87 1.64 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.4 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.36 -50.18 12.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.28 -179.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 1.017 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.7 mp0 -48.14 -53.1 17.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.516 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.762 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.11 -47.25 85.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.324 -179.087 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.5 -40.41 37.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.958 0.409 . . . . 0.0 110.352 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.589 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.91 -47.86 60.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.945 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.97 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.11 -44.31 64.38 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.241 0.543 . . . . 0.0 109.919 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -76.88 -27.3 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.078 179.033 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.589 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.82 -52.41 37.2 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.01 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.74 -28.89 62.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.441 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.493 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.21 -40.77 97.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.65 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 -79.0 -27.39 43.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.033 0.444 . . . . 0.0 110.466 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -73.46 -52.49 13.47 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.269 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -58.97 -52.2 66.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.138 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.495 ' CD2' HG12 ' A' ' 78' ' ' ILE . 74.5 mt -53.99 -42.81 69.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.449 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -13.03 60.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.478 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.48 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.231 0.124 0 CA-C-O 121.115 0.483 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.909 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.41 130.14 53.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.651 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.633 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.44 120.79 25.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.446 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.02 170.92 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.411 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.2 m -159.58 123.98 3.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 111.098 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.507 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.73 178.97 19.12 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.765 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.78 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.1 mt -133.6 118.02 17.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.969 0.385 . . . . 0.0 111.469 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.029 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.2 mt -87.52 91.64 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.853 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -78.12 146.29 8.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.587 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.66 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 35.9 p90 -150.04 123.24 8.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -81.66 113.07 19.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 120.96 0.409 . . . . 0.0 112.046 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 120.947 0.403 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.66 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -117.2 140.98 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.433 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.3 mp0 -126.91 138.51 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.889 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.545 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 49.8 m-85 -100.59 152.24 20.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.97 0.414 . . . . 0.0 112.05 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 15' ' ' ILE . 53.0 tp -84.02 134.37 34.63 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.774 178.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 43' ' ' TRP . 3.6 mt -132.62 142.41 49.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.863 0.363 . . . . 0.0 110.951 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 112' ' ' LEU . 3.4 mt -123.11 104.92 9.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.891 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.476 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 2.6 tt0 -59.88 133.68 56.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.656 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.2 p80 . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.811 0.339 . . . . 0.0 110.603 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.744 ' HB3' HD22 ' A' ' 33' ' ' LEU . 63.7 m95 -97.38 130.52 44.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.173 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.786 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -152.62 136.37 10.02 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 18.2 Cg_endo -57.37 179.91 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.866 2.377 . . . . 0.0 112.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.538 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.7 Cg_exo -63.91 117.09 4.11 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.644 2.229 . . . . 0.0 112.543 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.82 128.91 55.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.408 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.472 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -117.36 173.37 14.72 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.351 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -109.99 103.63 12.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.914 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.633 HG13 ' HB3' ' A' ' 9' ' ' ARG . 2.1 p -86.7 121.91 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.919 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.509 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 1.5 tt0 -93.73 154.01 41.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.971 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.509 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 3.4 Cg_exo -42.4 -46.44 7.72 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.745 2.297 . . . . 0.0 112.35 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.458 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.64 -11.46 82.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.107 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -85.29 164.33 18.08 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.855 0.327 . . . . 0.0 110.969 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.851 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 25.1 t70 -85.08 159.24 20.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.208 0.528 . . . . 0.0 110.772 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.412 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 21.3 m-20 -71.42 -66.42 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.618 HD21 HG21 ' A' ' 77' ' ' ILE . 12.1 tp -59.23 -40.44 85.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.279 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.85 -50.54 45.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.856 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.575 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.3 m -55.47 -36.05 66.18 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -75.84 -32.67 59.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.758 178.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.669 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.7 mt -73.37 -53.28 11.13 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.044 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -57.9 -43.66 86.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.147 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.79 -34.66 73.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.582 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.853 HG23 HD11 ' A' ' 15' ' ' ILE . 28.4 m -59.39 -53.63 55.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.521 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 4.9 pt20 -74.12 -21.44 59.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.17 -35.82 41.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 110.968 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.429 ' HB3' HD13 ' A' ' 34' ' ' LEU . 8.1 mt-10 -112.24 6.63 19.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.85 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -151.49 -12.15 0.21 Allowed 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.497 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 77.64 -2.76 62.24 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.29 -0.957 . . . . 0.0 112.784 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.619 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.9 mt -100.38 124.77 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.905 0.384 . . . . 0.0 110.831 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -108.58 167.05 10.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.767 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -45.85 -38.54 7.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.648 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.38 -20.53 73.56 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.241 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.421 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.5 tp60 -96.59 -5.68 38.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.519 0.199 . . . . 0.0 111.021 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.08 -168.81 2.15 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.906 0.384 . . . . 0.0 110.369 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.499 ' H ' ' H ' ' A' ' 102' ' ' GLU . 87.7 m -137.11 100.74 4.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.654 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 57' ' ' LEU . 8.1 mm -72.94 125.27 31.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.962 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.491 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.62 133.38 29.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.292 0.568 . . . . 0.0 111.41 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.16 151.92 20.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.205 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 99.76 -22.24 41.33 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.657 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.879 ' CE1' HD21 ' A' ' 100' ' ' LEU . 14.2 t80 -106.03 131.7 53.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 110.911 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.507 ' HD2' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.25 131.92 8.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.232 0.539 . . . . 0.0 111.109 179.778 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -159.39 139.32 11.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.081 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.906 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -126.39 134.27 51.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.913 0.387 . . . . 0.0 111.359 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.877 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.4 mt -93.18 118.74 31.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.98 125.67 53.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.858 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.456 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 22.2 p90 -166.85 142.67 4.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.844 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.576 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.4 p -81.73 112.34 19.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.019 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.4 -107.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -35.84 78.92 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.928 0.394 . . . . 0.0 110.748 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.93 28.55 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.857 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.741 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.9 tppt? -158.53 125.95 2.69 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.99 0.424 . . . . 0.0 111.321 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.769 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.2 Cg_endo -70.16 116.59 4.67 Favored 'Trans proline' 0 CA--C 1.513 -0.555 0 C-N-CA 123.358 2.706 . . . . 0.0 113.096 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.909 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -99.84 123.17 43.82 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.267 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.3 m -88.6 114.18 24.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.664 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.0 t -112.85 108.19 24.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.901 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.906 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.29 128.6 39.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.602 ' HB3' HG13 ' A' ' 14' ' ' ILE . 20.3 m-85 -117.95 128.58 54.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.241 0.543 . . . . 0.0 112.269 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.507 ' NE1' ' HD2' ' A' ' 82' ' ' LYS . 17.7 m-90 -109.99 167.48 10.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.579 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.879 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -103.03 110.91 23.0 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.537 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -118.23 154.49 32.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.499 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tt0 -130.97 115.24 16.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.726 HG12 HD23 ' A' ' 75' ' ' LEU . 5.3 m -73.97 122.2 26.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 121.345 0.593 . . . . 0.0 111.273 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -24.12 66.25 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.166 -178.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.772 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.5 t0 -104.44 117.9 35.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.081 0.467 . . . . 0.0 112.041 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -57.62 -42.81 84.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.0 25.24 8.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.904 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -44.06 142.54 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.869 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -63.53 142.45 58.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.252 0.549 . . . . 0.0 111.422 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.808 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.5 mm -121.05 97.4 4.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.503 179.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.497 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 8.3 mtp180 -102.17 101.69 12.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.88 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 34' ' ' LEU . 10.1 mt -90.73 178.72 5.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.353 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.66 -158.27 0.85 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.996 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -78.73 -3.45 44.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.4 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.78 -22.47 20.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.657 0.265 . . . . 0.0 111.104 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.37 116.71 17.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.41 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -3.49 58.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.913 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -168.72 164.37 12.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 0.0 111.4 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.808 ' CD1' HG21 ' A' ' 110' ' ' ILE . 41.0 p90 -141.33 168.12 20.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.625 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.435 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 6.1 mtt180 -156.45 159.76 38.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.452 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.1 m95 -124.26 107.64 11.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.638 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -136.33 172.74 12.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.98 0.419 . . . . 0.0 111.342 -178.855 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.56 -153.99 7.29 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.959 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.9 tp -77.21 -42.41 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.649 0.261 . . . . 0.0 111.157 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.5 pt-20 -60.81 -50.08 74.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.316 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.82 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.22 -46.9 54.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.651 -179.401 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.535 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.03 -30.65 48.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.414 0.626 . . . . 0.0 109.636 178.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.5 m -83.71 -34.45 24.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.52 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.82 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.04 -41.44 99.5 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 121.091 0.472 . . . . 0.0 109.938 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.594 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.1 mt -77.89 -45.88 22.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.129 179.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.489 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.0 53.74 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.437 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.18 -31.49 0.05 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.585 -179.571 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -57.19 115.94 2.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.13 0.49 . . . . 0.0 110.412 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.85 -40.01 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.473 -179.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.877 ' HB3' HD13 ' A' ' 85' ' ' LEU . 41.8 mp0 -58.1 -54.08 50.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.72 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.786 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -63.42 -39.65 95.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.749 0.309 . . . . 0.0 110.489 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.79 -37.95 60.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.19 -46.01 36.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.946 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 1.029 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.25 -45.98 62.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.211 0.529 . . . . 0.0 110.314 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.631 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.52 -29.78 59.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.045 179.012 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.578 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -65.54 -51.33 60.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.792 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.56 -29.67 67.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.61 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.8 -44.94 94.04 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.986 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.431 ' NE2' HD12 ' A' ' 29' ' ' ILE . 10.4 t-80 -78.78 -30.81 45.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -64.76 -52.36 57.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -61.56 -53.55 54.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.819 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.491 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.7 mt -56.02 -24.79 41.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.574 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.61 -10.93 56.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.532 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.871 179.623 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.826 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.516 -0.35 0 CA-C-O 121.696 0.76 . . . . 0.0 112.124 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.761 ' N ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.29 145.99 42.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.132 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.637 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.3 ttt85 -78.82 118.92 21.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.592 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.919 ' HB2' ' CE ' ' A' ' 94' ' ' LYS . . . -127.3 166.64 17.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.058 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -159.24 123.84 4.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.078 0.466 . . . . 0.0 111.762 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.489 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -120.61 171.92 14.87 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.496 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.773 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -125.36 118.18 25.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 117.07 0.435 . . . . 0.0 111.976 -179.171 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.93 HD11 ' HB1' ' A' ' 139' ' ' ALA . 48.6 mt -86.24 91.74 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.985 HD11 HG23 ' A' ' 64' ' ' THR . 30.3 mt -78.88 142.82 13.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.049 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.0 p90 -145.52 121.33 10.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.329 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.451 ' HG2' ' CD1' ' A' ' 106' ' ' TYR . 20.3 tpt180 -81.0 113.34 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.916 0.389 . . . . 0.0 110.075 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.666 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.929 0.395 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.72 HD12 ' NE2' ' A' ' 144' ' ' HIS . 6.5 mt -115.93 141.61 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.976 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -128.84 141.77 51.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.991 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.7 m-85 -103.52 145.41 30.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.979 0.419 . . . . 0.0 111.843 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.549 HD23 HD12 ' A' ' 15' ' ' ILE . 52.1 tp -78.2 135.41 37.61 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.112 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' HB3' ' A' ' 43' ' ' TRP . 6.2 mt -134.23 145.4 49.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.002 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 112' ' ' LEU . 6.6 mt -123.16 113.46 18.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.088 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.469 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.0 tt0 -76.64 147.69 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.559 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.092 179.762 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 22.1 p80 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.843 0.354 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 130' ' ' LEU . 65.7 m95 -102.12 135.02 44.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.8 153.38 27.47 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.6 172.88 15.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.73 2.287 . . . . 0.0 112.42 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.6 ' HG3' HD11 ' A' ' 34' ' ' LEU . 15.9 Cg_exo -66.11 86.58 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.617 2.211 . . . . 0.0 112.463 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 3.6 pttt -99.95 146.75 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.935 0.397 . . . . 0.0 110.892 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.28 -173.78 13.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.603 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 m80 -112.95 99.19 7.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.643 0.259 . . . . 0.0 110.72 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.719 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -67.01 130.54 32.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.048 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' N ' ' A' ' 52' ' ' PRO . 2.0 tt0 -96.93 151.11 37.56 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.243 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.462 ' N ' ' HG2' ' A' ' 51' ' ' GLU . 82.2 Cg_exo -39.63 -62.36 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.818 2.345 . . . . 0.0 112.463 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.31 -19.0 63.74 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.535 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -79.96 158.92 26.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.799 0.333 . . . . 0.0 110.657 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.862 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 6.0 t70 -83.33 163.26 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.289 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.506 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -71.86 -64.39 0.94 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.154 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 26.5 tp -62.3 -42.88 99.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.418 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.862 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -49.15 -45.68 44.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.758 0.314 . . . . 0.0 110.497 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.719 HG21 ' N ' ' A' ' 50' ' ' VAL . 84.9 m -55.81 -45.19 78.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.125 0.488 . . . . 0.0 109.889 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.51 -28.87 65.29 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.22 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.976 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.6 mt -72.78 -52.46 14.9 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.056 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -57.17 -46.89 82.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.779 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.03 -33.93 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 0.0 110.224 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.985 HG23 HD11 ' A' ' 15' ' ' ILE . 34.0 m -60.13 -52.31 65.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.506 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.521 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -79.19 -22.89 44.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.305 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -78.72 -36.63 43.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.688 0.28 . . . . 0.0 111.207 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 4.5 mm-40 -103.21 -18.09 15.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.721 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.641 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -125.04 -11.92 7.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.67 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 82.24 -10.78 52.8 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 119.85 -1.167 . . . . 0.0 112.423 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.787 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -96.6 122.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 21.0 pm0 -105.64 171.53 7.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.088 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.976 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.59 -34.79 18.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.459 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -16.09 77.32 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.4 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.543 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.2 mm-40 -100.12 -10.57 21.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.547 0.213 . . . . 0.0 110.88 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.32 -169.4 2.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.85 0.357 . . . . 0.0 110.276 179.286 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.9 m -135.76 100.64 4.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.114 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.668 HD13 ' HB2' ' A' ' 101' ' ' ALA . 11.3 mm -74.13 114.17 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.12 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.553 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -78.19 138.68 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 121.09 0.471 . . . . 0.0 110.826 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -95.54 149.4 21.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.0 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.22 -22.07 33.9 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.247 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.632 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.2 t80 -106.64 127.82 53.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.767 0.317 . . . . 0.0 111.16 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.413 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.94 127.88 6.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 111.73 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -151.74 138.61 18.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.8 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -119.8 123.62 44.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.946 0.403 . . . . 0.0 111.481 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 135' ' ' GLU . 9.0 mt -91.08 116.19 28.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.668 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.9 p30 -117.06 130.54 56.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.125 0.488 . . . . 0.0 110.719 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.532 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 18.4 p90 -166.86 139.24 3.52 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.795 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.819 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 8.7 p -81.1 116.14 24.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.34 0.591 . . . . 0.0 111.259 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.63 -92.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.066 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -46.08 13.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.943 0.402 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -166.7 23.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.545 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.605 ' C ' HG23 ' A' ' 88' ' ' VAL . 0.2 OUTLIER -155.77 125.66 3.26 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.707 179.804 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.826 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 39.6 Cg_endo -68.37 -173.79 0.59 Allowed 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.137 1.892 . . . . 0.0 111.649 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.919 ' CE ' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -160.56 112.53 1.94 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.353 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.494 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 89.3 m -86.89 100.93 12.92 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.706 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 47.9 t -103.51 108.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.742 -178.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.22 123.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.733 ' HB3' HG13 ' A' ' 14' ' ' ILE . 29.8 m-85 -109.79 129.02 55.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.366 0.603 . . . . 0.0 112.579 -177.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.536 ' CD2' HD13 ' A' ' 57' ' ' LEU . 7.0 m-90 -115.16 149.59 37.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.985 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.632 HD21 ' CE1' ' A' ' 81' ' ' PHE . 4.0 mt -82.83 121.88 27.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.668 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.57 135.54 48.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.5 tt0 -113.59 117.48 31.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.71 0.29 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 6.4 m -74.79 112.81 12.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.361 0.601 . . . . 0.0 110.579 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -25.78 42.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.802 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.79 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 64.0 t0 -101.06 116.41 32.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.991 0.424 . . . . 0.0 111.101 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.451 ' CD1' ' HG2' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -61.82 -42.31 98.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.105 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.49 21.37 9.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.874 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.79 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.4 p -44.57 143.05 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.243 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.401 ' HG3' ' HE ' ' A' ' 111' ' ' ARG . 2.6 pm0 -65.26 146.04 55.45 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.406 0.622 . . . . 0.0 111.221 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.787 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.83 98.58 5.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.293 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.67 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 8.9 mtt-85 -96.88 105.78 17.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.426 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.638 HD21 ' CG2' ' A' ' 110' ' ' ILE . 9.0 mt -99.63 120.87 40.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.958 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.28 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.658 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -87.63 19.36 3.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.612 0.244 . . . . 0.0 111.171 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -107.09 -43.73 4.55 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 45.3 m80 -98.24 132.6 43.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.703 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -93.03 -22.48 19.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.647 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.92 166.88 23.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 111.7 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.729 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.1 p90 -139.23 174.76 10.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.417 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 120' ' ' ARG . 0.1 OUTLIER -160.01 158.52 30.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.147 0.499 . . . . 0.0 111.624 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.404 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 85.8 m95 -123.0 106.96 11.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.62 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.34 165.27 26.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.83 -151.22 2.54 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.364 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.498 HD21 ' CD ' ' A' ' 141' ' ' GLN . 6.9 tp -76.55 -42.8 41.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.86 0.362 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -61.5 -52.49 64.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.83 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.705 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -68.92 -45.0 71.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.97 0.414 . . . . 0.0 110.615 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.16 66.36 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.266 0.555 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.52 -32.33 25.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.257 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -65.18 -44.49 88.32 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -76.23 -44.81 35.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.753 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.09 55.34 1.79 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.814 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -38.75 -34.2 0.14 Allowed 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.415 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.47 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 14.1 m-85 -55.92 118.18 4.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.678 -179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -45.55 -50.91 12.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.52 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.773 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.0 mp0 -46.6 -54.69 8.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.776 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.413 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -64.21 -45.21 89.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.118 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.22 -41.7 50.33 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.302 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -70.64 -47.93 57.52 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.777 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.93 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.86 -42.75 62.88 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.138 0.494 . . . . 0.0 110.307 179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.47 -31.55 42.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.95 178.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.54 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.52 -51.19 66.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.596 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.556 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -70.97 -27.63 63.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.936 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -59.05 -49.35 79.4 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.256 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.72 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.6 t-160 -74.3 -29.12 61.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.922 0.391 . . . . 0.0 110.624 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -67.41 -52.32 41.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.177 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -62.05 -53.14 59.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.21 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.553 ' CD2' HG12 ' A' ' 78' ' ' ILE . 76.6 mt -54.67 -28.34 46.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.851 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -10.95 59.71 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.866 0.365 . . . . 0.0 110.808 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.801 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.612 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.161 0 CA-C-O 121.231 0.539 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.903 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -108.24 128.13 54.45 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.096 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.566 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -79.57 116.59 19.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.658 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.514 ' HB3' ' HD3' ' A' ' 94' ' ' LYS . . . -132.78 168.82 17.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.047 0.451 . . . . 0.0 111.619 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 17.7 m -156.31 123.99 5.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.261 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.516 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.93 176.71 17.75 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.76 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.761 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.2 mt -129.96 120.87 25.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 117.237 0.519 . . . . 0.0 112.322 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.65 HD11 ' CG ' ' A' ' 98' ' ' TYR . 5.7 mm -80.63 91.77 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.928 HD11 HG23 ' A' ' 64' ' ' THR . 75.7 mt -84.88 136.7 22.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.574 -177.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.708 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 45.2 p90 -150.17 131.16 14.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.283 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.66 113.95 24.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 110.334 178.721 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.742 ' NH1' HD11 ' A' ' 29' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.435 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.633 0.254 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.742 HD11 ' NH1' ' A' ' 18' ' ' ARG . 6.3 mt -109.63 144.14 18.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.477 0.656 . . . . 0.0 112.094 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.627 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.0 mm-40 -124.1 172.67 8.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.589 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 40.4 m-85 -133.46 133.94 42.91 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.688 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD23 ' CD1' ' A' ' 15' ' ' ILE . 29.8 tp -75.38 134.58 40.92 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 6.3 mt -135.06 135.43 41.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.082 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.643 HD11 ' HG3' ' A' ' 46' ' ' PRO . 38.9 mt -112.51 102.3 10.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 5.2 tm0? -61.62 134.35 56.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 111.735 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.821 179.56 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.682 0.277 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.68 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 32.9 m95 -92.84 139.68 30.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.147 0.499 . . . . 0.0 111.957 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.403 ' HB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -157.9 139.12 9.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.002 179.233 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.446 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.3 Cg_endo -66.85 175.51 5.35 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.232 1.955 . . . . 0.0 112.001 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.643 ' HG3' HD11 ' A' ' 34' ' ' LEU . 32.1 Cg_exo -59.4 113.01 1.42 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.762 2.308 . . . . 0.0 112.55 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -112.5 141.44 46.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.829 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.479 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.51 167.8 21.28 Favored Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.629 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.437 ' CE1' ' HE2' ' A' ' 94' ' ' LYS . 48.8 m-70 -113.86 101.89 9.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.811 0.339 . . . . 0.0 110.706 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.59 ' N ' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -67.77 129.98 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.572 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -90.61 172.11 7.37 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.724 -179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 73.3 Cg_exo -50.03 -63.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.57 2.18 . . . . 0.0 112.733 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.03 10.38 58.14 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.292 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 16.7 tt0 -89.22 161.51 16.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.044 0.422 . . . . 0.0 110.912 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.898 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 8.6 t0 -86.81 162.94 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.763 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.495 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -75.15 -63.23 1.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.842 0.353 . . . . 0.0 111.224 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.703 HD21 HG21 ' A' ' 77' ' ' ILE . 26.8 tp -62.75 -40.89 98.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.36 -47.94 55.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.48 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.59 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.6 m -54.19 -42.61 69.92 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.16 -37.13 75.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.825 178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.879 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.2 mt -64.8 -52.7 55.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.593 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.4 tpt180 -62.87 -40.32 97.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.442 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.479 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -63.17 -32.22 73.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.06 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.928 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -65.1 -49.46 69.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.681 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.52 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -76.92 -22.88 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.877 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -79.29 -33.47 43.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.853 0.359 . . . . 0.0 111.228 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -106.74 -16.63 14.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.664 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.85 -6.81 4.51 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.501 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 75.25 -5.57 33.98 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.77 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 74' ' ' GLN . 2.8 mt -98.97 124.22 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 CA-C-N 117.013 0.407 . . . . 0.0 110.529 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 9.6 pt-20 -110.31 170.65 7.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.106 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.879 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.44 -32.51 3.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.828 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.6 -25.75 74.51 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.088 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.693 ' HB3' HG23 ' A' ' 70' ' ' ILE . 11.2 mm-40 -94.41 1.47 55.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.409 0.147 . . . . 0.0 111.146 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.39 -173.92 3.89 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.924 0.392 . . . . 0.0 110.705 178.57 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.556 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 42.4 m -135.93 98.15 3.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.686 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.737 HD12 HD21 ' A' ' 13' ' ' LEU . 11.5 mm -68.69 107.72 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.453 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.502 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.58 133.09 32.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 121.274 0.559 . . . . 0.0 110.715 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -90.96 150.9 21.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.212 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.19 -25.67 22.83 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.092 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.476 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.7 t80 -102.43 119.96 39.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.8 0.333 . . . . 0.0 111.091 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.524 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -149.75 124.75 9.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.275 0.559 . . . . 0.0 110.86 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -148.79 138.14 21.76 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.7 pm0 -118.25 121.06 39.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.034 0.445 . . . . 0.0 111.047 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.8 HD13 ' CB ' ' A' ' 135' ' ' GLU . 5.5 mt -85.09 123.45 30.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.35 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.416 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.2 m-80 -115.45 120.29 39.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.642 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -167.33 141.18 3.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.818 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.621 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.6 p -81.46 109.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.238 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.53 -100.68 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.039 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -38.58 89.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 173.64 28.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.646 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.846 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -157.02 130.15 4.49 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.495 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.903 ' O ' HD12 ' A' ' 8' ' ' LEU . 41.1 Cg_endo -65.46 120.12 7.26 Favored 'Trans proline' 0 CA--C 1.512 -0.594 0 C-N-CA 123.263 2.642 . . . . 0.0 112.368 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.524 ' HD3' HG22 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -103.74 127.24 51.23 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.859 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 69.5 m -100.12 105.14 16.73 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.682 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 52.8 t -105.48 107.72 23.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.933 -178.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.76 111.47 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CG ' HD11 ' A' ' 14' ' ' ILE . 7.4 m-85 -91.05 166.02 13.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.524 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -157.01 134.07 10.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.421 -179.552 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.526 HD13 ' HG ' ' A' ' 147' ' ' LEU . 1.3 mt -73.41 132.69 43.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.301 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.706 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -139.51 138.61 36.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.146 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.708 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.3 tt0 -108.85 109.52 20.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.895 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.767 HG12 HD23 ' A' ' 75' ' ' LEU . 6.1 m -72.49 149.86 8.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.211 0.529 . . . . 0.0 111.39 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.15 -8.18 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.933 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.469 ' O ' HG12 ' A' ' 108' ' ' VAL . 3.2 t70 -149.47 117.88 6.49 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.165 0.507 . . . . 0.0 112.238 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CA ' ' HG3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -49.68 -39.73 37.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.315 0.579 . . . . 0.0 110.365 178.43 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -101.54 25.0 8.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.877 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 105' ' ' ASP . 3.4 p -43.92 156.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.109 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.657 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 3.1 pm0 -60.94 139.7 57.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.274 0.559 . . . . 0.0 110.917 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.807 HG21 ' CD1' ' A' ' 119' ' ' TYR . 45.8 mm -122.14 99.52 7.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.429 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.501 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 2.4 mtt180 -102.7 96.61 6.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.317 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.728 HD21 ' CG2' ' A' ' 110' ' ' ILE . 5.6 mt -86.86 149.55 24.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.834 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.8 m -88.9 -170.14 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -71.49 -5.59 34.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.603 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.0 -24.3 18.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 110.965 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 14.8 m80 -106.52 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.642 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -123.72 -20.76 5.38 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -161.87 171.85 17.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.158 0.504 . . . . 0.0 111.857 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.807 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.1 p90 -149.43 177.73 9.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.504 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.4 mtt180 -166.6 162.91 16.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.316 0.579 . . . . 0.0 111.949 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.403 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 80.4 m95 -125.17 106.8 10.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.224 178.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.779 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -134.85 170.46 15.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 0.0 111.819 -178.698 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.31 -152.95 5.41 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.827 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.474 HD21 ' NE2' ' A' ' 141' ' ' GLN . 5.7 tp -77.72 -42.93 32.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.69 0.281 . . . . 0.0 111.59 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.537 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.7 pt-20 -60.69 -49.69 76.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.488 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.779 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -69.58 -52.35 26.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.93 0.395 . . . . 0.0 110.006 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.56 -28.12 8.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.382 0.611 . . . . 0.0 109.68 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.431 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 1.0 OUTLIER -83.05 -38.3 22.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.871 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.608 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -58.34 -47.73 82.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.995 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.63 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -77.16 -40.34 45.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.504 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -76.74 54.62 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.634 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -39.34 -35.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.822 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.419 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 6.5 m-85 -58.43 120.62 9.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -46.77 -48.38 20.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.8 ' CB ' HD13 ' A' ' 85' ' ' LEU . 2.1 mp0 -51.17 -53.37 35.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.486 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.663 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -58.62 -39.52 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.057 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -56.99 -44.94 83.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.935 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -66.52 -46.55 75.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.493 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -52.52 -44.63 65.87 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.939 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.663 HD12 ' O ' ' A' ' 136' ' ' MET . 0.9 OUTLIER -80.9 -26.65 36.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.222 179.171 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.584 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 1.8 mm-40 -68.77 -51.81 37.1 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -74.57 -31.61 62.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.597 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.52 -48.3 60.96 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.165 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.436 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 8.2 t-80 -74.95 -32.25 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.041 0.448 . . . . 0.0 110.579 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 31.9 tp60 -64.85 -52.41 56.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.512 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -58.03 -54.16 50.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.262 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.526 ' HG ' HD13 ' A' ' 100' ' ' LEU . 72.5 mt -58.0 -32.17 67.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.857 -179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -15.99 58.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.787 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.666 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.121 0.486 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -102.71 132.91 48.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.643 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.592 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.65 122.64 28.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.319 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -135.73 165.57 25.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.752 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.676 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 57.8 m -154.41 123.22 6.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.145 0.497 . . . . 0.0 111.236 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.409 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.41 172.41 14.27 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.535 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.834 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -126.65 117.17 22.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.018 0.409 . . . . 0.0 111.249 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.824 HD11 ' HB1' ' A' ' 139' ' ' ALA . 76.1 mt -83.95 90.84 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HG23 ' A' ' 64' ' ' THR . 43.2 mt -80.71 145.45 8.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.77 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 47.6 p90 -149.84 122.14 8.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.302 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.795 ' HD3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -81.54 112.9 19.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.274 179.268 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 120.796 0.332 . . . . 0.0 111.419 -179.676 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.822 0.344 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.7 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.4 mt -107.82 143.12 18.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.254 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 1.4 mt-10 -134.7 124.94 26.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.034 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.7 m-85 -89.66 144.6 25.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.65 HD23 HD12 ' A' ' 15' ' ' ILE . 43.1 tp -86.1 131.13 34.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.777 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.528 HD12 ' CD1' ' A' ' 122' ' ' LEU . 6.6 mt -129.69 140.16 51.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.618 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.498 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.7 mt -119.75 103.99 9.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.806 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 49.2 tt0 -57.85 119.79 7.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.409 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 179.716 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.573 0.225 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 48.9 m95 -108.13 110.19 21.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.844 0.355 . . . . 0.0 111.264 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.404 ' HB ' ' CD ' ' A' ' 47' ' ' LYS . 53.7 p -128.93 130.6 23.45 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.102 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.56 179.57 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.47 2.113 . . . . 0.0 112.102 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.638 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.6 Cg_exo -54.23 99.96 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.122 1.881 . . . . 0.0 112.093 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -99.34 140.83 32.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.862 0.363 . . . . 0.0 110.927 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.33 164.55 26.56 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.381 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -102.4 111.67 24.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.628 0.251 . . . . 0.0 110.582 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.592 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -86.45 134.34 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.447 0.641 . . . . 0.0 111.291 -179.681 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.786 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 9.0 tt0 -90.64 150.47 42.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.122 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.14 -23.37 22.22 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.761 2.307 . . . . 0.0 112.972 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.786 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.66 -11.24 38.58 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.509 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -84.66 166.51 17.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.894 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.4 t70 -80.35 159.0 25.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.214 0.531 . . . . 0.0 110.263 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.55 -66.39 0.63 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.734 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.634 HD21 HG21 ' A' ' 77' ' ' ILE . 30.9 tp -63.12 -38.06 89.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.437 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.894 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.84 -50.48 45.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.708 0.289 . . . . 0.0 110.498 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.47 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 53.9 m -54.62 -45.89 73.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 109.938 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.676 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -66.41 -29.21 69.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.184 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.964 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -74.6 -52.3 12.13 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.466 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -43.71 90.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.416 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.05 -32.83 72.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.388 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.862 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -61.55 -52.77 63.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.466 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.455 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.1 tt0 -75.06 -23.0 58.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.4 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -79.49 -40.05 30.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.877 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -104.16 1.41 30.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.095 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -147.13 -12.44 0.42 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.598 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 78.87 -7.91 47.41 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.779 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.821 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.8 mt -96.32 122.49 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.529 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 6.0 pt-20 -104.48 167.42 9.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.964 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.23 -35.76 8.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.526 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.08 -23.77 76.04 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.018 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.464 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 3.6 tp60 -94.96 -5.65 44.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.793 0.33 . . . . 0.0 111.198 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.923 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.51 -170.99 2.54 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.443 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.526 ' H ' ' H ' ' A' ' 102' ' ' GLU . 35.7 m -137.75 100.86 4.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.691 HD12 HD21 ' A' ' 13' ' ' LEU . 13.3 mm -73.15 109.76 5.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.188 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.556 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -71.63 136.22 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.962 0.411 . . . . 0.0 110.427 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -93.72 149.74 20.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.511 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.0 -15.96 54.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.528 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.71 ' CD2' HD11 ' A' ' 100' ' ' LEU . 18.9 t80 -104.78 135.62 45.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.76 0.315 . . . . 0.0 111.24 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.608 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.99 138.1 12.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.126 0.488 . . . . 0.0 111.437 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 142.78 5.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.347 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.846 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.5 pm0 -132.51 127.34 34.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.903 0.382 . . . . 0.0 111.176 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.024 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.3 mt -90.55 117.31 29.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.433 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -113.96 126.56 55.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.774 -178.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 22.3 p90 -167.71 141.58 3.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.01 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.616 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.6 p -84.97 111.88 21.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.136 0.493 . . . . 0.0 110.246 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.26 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.442 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -80.0 -37.69 33.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.825 0.345 . . . . 0.0 110.704 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.67 26.99 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.169 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.689 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.62 122.09 2.66 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-O 120.899 0.381 . . . . 0.0 110.896 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.0 Cg_endo -71.68 118.21 5.53 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.223 2.615 . . . . 0.0 112.945 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.728 ' HD3' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -96.76 124.37 40.72 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.069 -179.27 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.513 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 88.7 m -94.14 110.25 21.98 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.5 t -109.89 107.57 23.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.386 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.846 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.62 128.74 39.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 14' ' ' ILE . 26.2 m-85 -114.07 136.39 52.97 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.608 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.5 m-90 -123.37 146.07 48.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.128 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.71 HD11 ' CD2' ' A' ' 81' ' ' PHE . 3.1 mt -78.63 125.97 30.1 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -132.67 147.71 52.34 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.687 0.28 . . . . 0.0 111.388 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.526 ' H ' ' H ' ' A' ' 76' ' ' THR . 7.5 tt0 -126.37 111.95 15.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.748 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.729 HG12 HD23 ' A' ' 75' ' ' LEU . 6.2 m -72.08 130.16 35.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.294 0.569 . . . . 0.0 110.81 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.55 -23.88 67.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.395 -177.88 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 5.7 t70 -107.13 130.23 54.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.074 0.464 . . . . 0.0 112.205 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.795 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 11.2 t80 -66.67 -37.08 84.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.931 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.61 26.4 10.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.064 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.8 p -43.8 146.86 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.925 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -71.3 142.55 50.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.344 0.592 . . . . 0.0 111.252 -179.166 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.821 ' CD1' HD11 ' A' ' 70' ' ' ILE . 43.0 mm -119.64 98.72 6.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.365 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.598 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 1.3 mtp85 -95.7 102.77 14.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.217 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.714 HD11 ' HD1' ' A' ' 119' ' ' TYR . 11.6 mt -100.24 139.85 35.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.804 179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.9 p -94.89 -154.94 0.44 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.601 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 19.12 1.06 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.521 0.201 . . . . 0.0 111.249 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -35.25 8.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.776 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.451 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 38.0 m80 -117.74 139.78 50.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.968 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -92.92 -16.18 25.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.247 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.42 177.35 3.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 111.332 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.776 ' CD1' HG21 ' A' ' 110' ' ' ILE . 49.5 p90 -148.2 169.71 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.756 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.43 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -159.18 153.48 23.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.159 0.504 . . . . 0.0 111.746 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -114.49 107.08 15.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.507 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.24 167.55 21.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.489 -178.579 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -152.56 3.73 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.636 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.2 tp -76.96 -45.47 27.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.929 0.365 . . . . 0.0 110.967 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.6 pt-20 -56.99 -51.34 69.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.489 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.798 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.74 -46.74 62.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.938 0.399 . . . . 0.0 110.539 -179.58 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.589 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -55.66 -30.62 61.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.262 0.553 . . . . 0.0 109.635 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 3.1 m -84.26 -29.7 26.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.433 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.798 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.18 -42.67 88.56 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.979 0.419 . . . . 0.0 110.719 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -77.57 -45.1 26.34 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.762 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.953 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.6 56.68 2.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.502 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -39.04 -34.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.152 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.439 ' O ' ' HD3' ' A' ' 137' ' ' LYS . 10.0 m-85 -58.82 123.85 17.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.81 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.53 -54.67 7.21 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 1.024 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -44.77 -57.88 3.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.918 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.953 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.26 -36.5 75.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.009 0.433 . . . . 0.0 110.575 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.439 ' HD3' ' O ' ' A' ' 133' ' ' PHE . 0.0 OUTLIER -62.7 -37.88 88.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.923 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.59 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.84 -45.6 67.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.578 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.824 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.23 -44.92 65.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.246 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.589 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -78.25 -29.64 48.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.016 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.59 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -62.28 -51.67 66.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.165 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -70.49 -30.03 66.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.716 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.7 -51.65 43.11 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -77.34 -29.2 53.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.86 0.362 . . . . 0.0 110.659 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.23 -52.51 54.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.008 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -60.6 -54.75 41.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.8 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.478 ' CD2' HG12 ' A' ' 78' ' ' ILE . 90.0 mt -54.73 -36.84 65.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.619 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 19.3 t -66.14 -13.16 59.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.063 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.37 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.26 0.552 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.65 139.88 41.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.563 179.704 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.695 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.37 118.18 23.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.982 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -129.81 165.67 21.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.977 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 11.2 m -157.79 123.94 4.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.203 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.619 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.2 172.91 14.62 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.182 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.775 HD12 ' OG1' ' A' ' 64' ' ' THR . 2.1 mt -125.83 117.74 24.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.764 0.316 . . . . 0.0 111.386 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.782 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.9 mt -85.3 91.0 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.835 HD11 HG23 ' A' ' 64' ' ' THR . 64.6 mt -79.13 139.86 17.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.096 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.615 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.4 p90 -144.13 121.16 11.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.41 -178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.866 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -87.34 118.59 26.88 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.69 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.6 ttm-85 . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.458 -179.219 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.806 0.336 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.615 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.5 mt -110.89 143.17 21.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.219 0.533 . . . . 0.0 111.791 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 11.7 mp0 -131.25 138.01 49.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.712 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.613 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.0 m-85 -101.38 152.23 20.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.047 0.451 . . . . 0.0 112.047 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.73 HD23 HD12 ' A' ' 15' ' ' ILE . 45.7 tp -86.72 138.51 31.57 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.96 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.3 mt -137.72 139.69 40.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.889 0.376 . . . . 0.0 111.006 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.811 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.4 mt -119.2 109.3 15.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.127 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.0 tt0 -64.78 140.78 58.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.075 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.169 179.19 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' A' ' 35' ' ' GLN . 40.1 m95 -98.63 145.1 27.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.663 -179.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.437 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.1 OUTLIER -161.62 149.61 12.33 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.656 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.538 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 38.4 Cg_endo -65.01 166.69 17.86 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.535 2.157 . . . . 0.0 111.974 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.811 ' HG3' HD11 ' A' ' 34' ' ' LEU . 18.1 Cg_exo -66.51 87.88 0.27 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.64 2.227 . . . . 0.0 112.519 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.619 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.6 pttt -98.81 145.32 27.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.42 -166.04 12.02 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.879 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 102.49 8.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.624 0.25 . . . . 0.0 111.021 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.742 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -76.74 122.05 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.898 0.38 . . . . 0.0 110.752 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -78.12 172.81 8.85 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.768 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 52.6 Cg_exo -54.62 -56.47 2.43 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.387 2.058 . . . . 0.0 112.305 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.08 14.3 61.01 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.974 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.502 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 71.0 tt0 -94.22 158.96 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.863 0.332 . . . . 0.0 110.661 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.0 t70 -79.37 159.47 27.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.65 -58.87 3.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.347 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.496 ' CD2' HG21 ' A' ' 77' ' ' ILE . 37.1 tp -65.74 -39.79 91.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.84 0.352 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.965 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.45 -49.98 53.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.442 179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.742 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.9 m -54.34 -42.79 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.491 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.97 -30.56 66.86 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.098 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 1.057 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.5 mt -71.16 -52.68 17.87 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.69 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 ttp85 -60.73 -41.32 95.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.478 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.659 ' HB1' ' OE1' ' A' ' 67' ' ' GLU . . . -62.09 -31.83 72.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.116 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.835 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -64.9 -49.9 68.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.432 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.6 pt20 -77.43 -26.27 51.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.74 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -79.34 -35.9 40.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.822 0.344 . . . . 0.0 111.023 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.659 ' OE1' ' HB1' ' A' ' 63' ' ' ALA . 2.3 mp0 -106.75 0.92 24.53 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.733 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.3 -7.12 0.41 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.583 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 73.64 -4.87 26.01 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.056 -1.069 . . . . 0.0 113.121 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.8 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.5 mt -100.09 126.75 53.52 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.08 0 CA-C-N 117.214 0.507 . . . . 0.0 110.503 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.505 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.0 pt-20 -109.02 169.55 8.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.424 . . . . 0.0 111.722 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 1.057 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.86 -35.55 10.54 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.818 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.19 -22.06 78.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.131 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.462 ' HB3' HG22 ' A' ' 70' ' ' ILE . 6.6 tp60 -97.31 0.85 48.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.494 0.187 . . . . 0.0 111.397 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.808 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.28 -176.51 4.74 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.117 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.602 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 65.5 m -132.45 100.48 4.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 111.463 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.655 HD12 HD21 ' A' ' 13' ' ' LEU . 9.7 mm -70.17 119.06 15.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.803 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.51 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.59 134.38 27.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.148 0.499 . . . . 0.0 111.113 -179.602 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -93.79 150.97 19.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.312 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.13 -22.96 37.82 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.332 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.861 ' CE1' HD21 ' A' ' 100' ' ' LEU . 19.0 t80 -105.75 126.04 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.579 0.228 . . . . 0.0 110.847 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.506 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 2.2 ttpt -157.55 126.74 5.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.159 0.504 . . . . 0.0 111.615 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.09 139.43 22.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.845 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -122.29 137.81 54.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.111 0.481 . . . . 0.0 111.55 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.005 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.0 mt -103.75 120.7 41.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.583 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -110.95 127.7 55.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.778 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.433 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 26.5 p90 -166.95 141.72 4.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.929 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.0 p -85.35 112.87 22.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.836 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.16 -95.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.525 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.81 -37.32 64.92 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-O 120.841 0.353 . . . . 0.0 110.712 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.0 t-20 178.21 26.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.105 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.712 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.01 124.4 3.4 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.049 179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 67.6 Cg_endo -74.2 118.91 5.57 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 123.145 2.563 . . . . 0.0 112.376 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.4 ttpt -103.59 126.36 50.68 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.616 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.9 m -87.62 107.29 18.54 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 18.4 t -105.52 108.31 24.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.026 -178.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -86.24 129.51 38.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.634 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.8 m-85 -113.63 131.98 55.93 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.506 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.3 m-90 -119.58 140.69 50.16 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.774 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.861 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -77.67 133.11 38.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.645 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -142.03 140.93 32.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.795 0.331 . . . . 0.0 111.541 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 8.4 tt0 -113.15 111.6 22.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.721 HG12 HD23 ' A' ' 75' ' ' LEU . 7.0 m -71.61 151.06 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.339 0.59 . . . . 0.0 111.65 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -75.7 -7.6 54.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.927 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.574 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 9.7 t70 -143.89 115.1 7.95 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-O 121.154 0.502 . . . . 0.0 112.349 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.866 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 0.4 OUTLIER -49.35 -40.21 34.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.694 178.885 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -102.95 24.72 10.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.793 178.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.574 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.3 p -43.52 151.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.667 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 109' ' ' GLU . 2.6 pm0 -61.24 138.78 58.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.346 0.593 . . . . 0.0 110.193 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.816 HG21 ' CG ' ' A' ' 119' ' ' TYR . 33.6 mm -121.87 98.07 5.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.295 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.583 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 21.6 mtp180 -97.1 105.64 17.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.196 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 13.7 mt -92.21 155.49 17.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 111.371 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.07 -168.06 1.54 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.641 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -67.1 -18.5 65.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.442 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -84.3 -14.24 50.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.652 0.263 . . . . 0.0 111.521 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 92.7 m-70 -117.99 164.26 15.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.967 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -138.56 -28.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.715 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.8 158.6 37.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.93 0.395 . . . . 0.0 111.619 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.816 ' CG ' HG21 ' A' ' 110' ' ' ILE . 44.4 p90 -135.81 173.51 11.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.446 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.481 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 13.6 mtt85 -156.64 156.42 33.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.304 0.573 . . . . 0.0 111.671 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -120.49 107.17 12.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.659 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.59 170.51 15.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.998 0.428 . . . . 0.0 111.714 -178.413 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.39 -159.8 20.96 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.147 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.526 HD21 ' CD ' ' A' ' 141' ' ' GLN . 7.4 tp -69.61 -41.32 75.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.709 0.29 . . . . 0.0 111.475 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.0 pt-20 -62.87 -51.06 68.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.587 -179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.673 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.42 -51.2 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.838 0.351 . . . . 0.0 110.494 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -51.1 -31.1 18.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.261 0.553 . . . . 0.0 109.638 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 7.0 m -83.39 -29.11 28.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.295 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.548 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -66.91 -45.18 78.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.548 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -75.23 -43.46 51.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.763 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.69 51.67 1.11 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.911 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -38.42 -33.57 0.1 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.527 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.472 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.6 m-85 -55.79 118.54 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.329 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.72 -50.84 13.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 1.005 ' HB3' HD13 ' A' ' 85' ' ' LEU . 17.3 mp0 -46.94 -51.02 17.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.021 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.625 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -67.4 -39.96 85.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.72 0.295 . . . . 0.0 111.139 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -54.64 -33.98 61.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.092 179.328 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.52 -45.41 21.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.652 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.782 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.98 -48.15 64.51 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.395 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.25 -26.65 59.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.245 179.107 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.43 -51.93 38.34 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.967 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.498 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 5.1 mp0 -69.27 -28.97 66.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.251 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.542 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.83 -43.29 99.41 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.719 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -75.91 -27.75 57.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -70.94 -52.47 19.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.355 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.71 -53.83 53.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 83.4 mt -54.77 -29.4 53.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.594 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -13.42 62.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.729 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.308 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.64 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.19 0 CA-C-O 121.137 0.494 . . . . 0.0 111.694 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.827 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -114.14 141.67 47.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.732 -179.765 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.863 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -80.66 126.56 31.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.773 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.925 ' HB2' ' HE2' ' A' ' 94' ' ' LYS . . . -137.72 161.62 36.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -156.44 123.08 5.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.17 0.51 . . . . 0.0 111.288 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.477 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.69 176.99 17.24 Favored Glycine 0 N--CA 1.446 -0.633 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.201 178.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.803 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -130.71 117.64 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.139 0.47 . . . . 0.0 111.177 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 98' ' ' TYR . 39.5 mt -84.13 90.3 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.647 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.946 HD11 HG23 ' A' ' 64' ' ' THR . 83.2 mt -79.93 145.36 9.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.413 -178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 47.9 p90 -152.6 127.72 9.76 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.124 -178.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -96.76 113.69 25.27 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.692 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.483 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.827 0.346 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.769 HD12 ' NE2' ' A' ' 144' ' ' HIS . 4.0 mt -106.15 150.85 8.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.42 0.628 . . . . 0.0 111.713 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.58 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 37.4 mm-40 -120.72 173.5 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.033 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 21.9 m-85 -141.37 128.75 21.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.598 0.237 . . . . 0.0 111.218 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 HD12 ' A' ' 15' ' ' ILE . 39.6 tp -73.0 140.45 47.34 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.614 HD11 ' HA ' ' A' ' 127' ' ' ALA . 8.0 mt -139.91 145.32 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.972 0.415 . . . . 0.0 111.074 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 112' ' ' LEU . 7.9 mt -123.77 112.22 17.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.238 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt0 -72.09 147.78 46.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.204 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.228 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.386 -179.927 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.3 p80 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.749 0.309 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.597 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.4 m95 -109.63 117.83 34.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.194 0.521 . . . . 0.0 111.499 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 ' SD ' ' A' ' 136' ' ' MET . 70.7 p -140.86 145.3 39.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.195 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LEU . 32.2 Cg_exo -57.7 170.71 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.995 1.797 . . . . 0.0 111.452 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.558 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 53.6 Cg_exo -52.03 95.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.328 2.019 . . . . 0.0 112.541 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER -88.55 130.08 35.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.727 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -143.78 123.72 2.11 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.612 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.688 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 23.2 p-80 -67.31 120.21 13.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.509 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.863 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -83.32 140.09 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.122 0.487 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.708 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 5.6 tt0 -91.76 149.49 39.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.93 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.7 Cg_endo -55.27 -20.82 26.39 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.958 2.438 . . . . 0.0 113.355 -178.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.682 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.56 -11.68 43.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.619 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -90.56 168.56 11.72 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.027 0.442 . . . . 0.0 110.911 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.801 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.1 t70 -81.76 160.79 23.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.463 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -69.21 -66.93 0.52 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.578 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD21 HG21 ' A' ' 77' ' ' ILE . 29.1 tp -62.21 -38.04 87.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.166 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.801 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -51.08 -46.82 61.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.721 -179.705 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.53 HG21 ' CA ' ' A' ' 50' ' ' VAL . 95.9 m -55.83 -46.46 78.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -65.4 -31.77 73.04 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.981 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.775 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.1 mt -72.14 -52.32 17.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.464 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 12.2 ttt-85 -62.41 -36.85 83.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.841 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.06 -31.65 72.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.946 HG23 HD11 ' A' ' 15' ' ' ILE . 24.4 m -62.51 -52.31 63.99 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.526 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -74.43 -24.38 59.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.739 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.6 -36.67 37.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.816 0.341 . . . . 0.0 110.597 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.69 10.58 22.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.683 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -158.53 -4.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.597 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 67.41 2.13 18.77 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.342 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.753 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -104.28 125.75 59.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 117.085 0.442 . . . . 0.0 110.363 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -107.94 170.44 7.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.282 -179.435 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.851 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.69 -31.63 7.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.212 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.38 -26.41 74.21 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.889 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.559 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 1.2 mm-40 -96.25 2.17 52.7 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -140.79 -179.15 5.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.047 0.451 . . . . 0.0 110.465 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.1 m -131.59 100.1 5.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.124 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.719 HD12 HD21 ' A' ' 13' ' ' LEU . 11.1 mm -71.1 112.29 5.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.022 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.572 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.18 134.07 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.026 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -93.16 150.93 20.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.74 39.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.16 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.683 ' CD1' HD21 ' A' ' 100' ' ' LEU . 21.1 t80 -104.41 123.49 47.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 110.607 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.47 128.69 6.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.276 0.56 . . . . 0.0 111.663 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -158.38 142.71 15.87 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.415 179.255 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.836 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -120.07 133.18 55.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.073 0.464 . . . . 0.0 111.93 -179.343 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.949 HD13 ' HB2' ' A' ' 135' ' ' GLU . 13.5 mt -97.53 116.19 29.27 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.731 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.2 p30 -115.53 133.34 56.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 111.506 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.406 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.2 p90 -166.74 140.07 3.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.64 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.671 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.9 p -81.26 107.19 13.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.338 0.59 . . . . 0.0 110.361 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.32 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.777 -178.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.0 57.37 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.309 . . . . 0.0 110.992 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 171.84 29.19 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.684 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.796 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.1 tptt -158.84 123.63 2.23 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.269 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.827 ' O ' HD12 ' A' ' 8' ' ' LEU . 33.3 Cg_endo -67.9 121.1 8.1 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.988 2.459 . . . . 0.0 113.245 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.925 ' HE2' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.87 113.62 25.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.806 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.3 m -87.76 105.5 17.43 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.693 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 39.5 t -108.03 108.38 25.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.836 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.13 122.54 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.583 ' HB3' HG13 ' A' ' 14' ' ' ILE . 40.4 m-85 -102.92 147.16 27.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -177.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.553 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.1 m-90 -135.07 138.39 43.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.347 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.683 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -74.55 135.43 42.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.523 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -139.75 139.11 36.4 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 120.777 0.322 . . . . 0.0 111.796 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.644 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 13.3 tt0 -113.09 107.94 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.256 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.67 HG12 HD23 ' A' ' 75' ' ' LEU . 9.0 m -72.1 139.76 19.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 121.329 0.585 . . . . 0.0 111.574 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 2.7 mptp? -69.25 -18.22 63.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.511 -178.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.669 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 18.8 t0 -124.25 127.77 48.18 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.532 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 t80 -60.65 -45.09 95.44 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.984 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -98.02 23.9 7.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.074 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.1 p -42.26 143.75 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.136 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -61.05 142.09 56.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.303 0.573 . . . . 0.0 111.144 -178.934 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.753 ' CD1' HD11 ' A' ' 70' ' ' ILE . 28.7 mm -124.55 96.46 3.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.093 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.597 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 1.4 mtt180 -98.88 102.53 14.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.666 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.499 HD21 ' CG2' ' A' ' 110' ' ' ILE . 11.0 mt -88.61 -178.59 5.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.6 m -127.45 -168.13 1.84 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.275 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.43 -13.42 62.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.578 0.214 . . . . 0.0 111.578 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.84 -18.88 29.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.35 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.439 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 98.5 m-70 -131.04 123.36 28.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.483 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.95 0.5 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.115 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.16 160.2 6.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.937 0.399 . . . . 0.0 111.612 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.747 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.7 p90 -142.03 174.36 10.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.744 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.404 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 15.4 mtt180 -159.46 159.69 33.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.262 0.553 . . . . 0.0 111.784 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.402 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 83.3 m95 -121.45 107.26 12.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.787 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -141.09 168.33 20.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 111.829 -178.639 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.48 -151.77 4.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.908 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 141' ' ' GLN . 15.5 tp -76.91 -49.06 16.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.778 0.323 . . . . 0.0 111.151 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -52.53 -52.09 56.43 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.614 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.818 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -69.57 -51.25 37.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.079 0.466 . . . . 0.0 110.436 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.614 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.93 -29.28 19.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.032 178.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.7 m -84.36 -33.86 23.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.49 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.818 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.67 -42.9 95.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.954 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -78.15 -44.69 25.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.185 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 137' ' ' LYS . . . -76.78 55.69 1.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.097 0.475 . . . . 0.0 109.934 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.379 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.431 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 45.8 m-85 -57.98 119.21 6.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.538 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.06 -46.75 33.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.735 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.949 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER -51.18 -51.25 55.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.891 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.477 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.74 -41.34 98.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 110.188 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -55.9 -35.28 66.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.75 178.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.05 -44.65 25.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.171 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.83 -53.28 50.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.363 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -69.91 -27.17 64.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.086 179.033 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.522 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.1 OUTLIER -63.22 -51.95 64.19 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.016 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.64 -27.0 60.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.539 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -53.92 -47.1 67.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.203 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.769 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.9 t-160 -78.81 -34.04 45.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.001 0.429 . . . . 0.0 110.611 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -62.31 -52.3 64.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.247 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -60.66 -52.61 64.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.133 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 93.1 mt -55.85 -31.88 63.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.483 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.66 -14.63 60.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.615 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.104 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.515 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.108 0.48 . . . . 0.0 111.704 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.912 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -105.53 134.24 48.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.367 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.724 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.4 ttm-85 -80.31 118.24 21.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.724 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -134.65 166.88 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.659 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.561 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.7 m -157.04 123.78 5.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.053 0.454 . . . . 0.0 111.103 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.563 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.05 176.44 17.08 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.857 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -131.01 117.72 19.58 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.879 HD11 ' HB1' ' A' ' 139' ' ' ALA . 70.2 mt -82.92 90.88 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.748 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -80.9 145.44 8.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.265 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.728 ' HB2' HG23 ' A' ' 29' ' ' ILE . 50.1 p90 -154.32 122.65 6.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.826 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -75.28 115.67 15.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.948 0.404 . . . . 0.0 110.729 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.236 179.903 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.67 0.272 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.728 HG23 ' HB2' ' A' ' 16' ' ' PHE . 9.1 mt -108.26 138.36 35.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.046 0.451 . . . . 0.0 111.873 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.64 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 60.0 mt-10 -134.19 119.44 18.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.973 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.639 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.9 m-85 -82.66 149.19 27.51 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 15' ' ' ILE . 38.9 tp -88.45 135.49 33.45 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.719 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.51 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.3 mt -135.82 141.54 44.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.808 0.337 . . . . 0.0 110.701 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.687 HD22 HD22 ' A' ' 112' ' ' LEU . 19.4 mt -119.64 112.77 19.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.97 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.464 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 3.8 tt0 -74.35 138.49 43.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.197 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.139 179.173 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 23.2 p80 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.897 0.379 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.666 ' CE2' HD22 ' A' ' 130' ' ' LEU . 24.9 m95 -106.03 119.48 39.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.533 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -143.49 141.79 19.77 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.133 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.63 158.44 8.11 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.719 2.28 . . . . 0.0 112.405 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.505 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 44.1 Cg_endo -66.62 101.28 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.723 2.282 . . . . 0.0 112.199 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.553 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.14 153.04 19.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.054 0.454 . . . . 0.0 111.561 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.496 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.13 164.19 22.23 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.273 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.474 ' CE1' ' HB3' ' A' ' 8' ' ' LEU . 1.1 t-80 -96.54 102.85 14.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.645 0.26 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.724 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -71.26 130.72 35.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.08 0.466 . . . . 0.0 111.149 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -89.92 174.69 4.48 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.748 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.533 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 51.3 Cg_exo -56.0 -60.52 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.292 1.995 . . . . 0.0 112.462 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.92 7.28 63.35 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.928 -0.653 . . . . 0.0 113.471 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 41.6 tt0 -88.9 164.88 14.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 110.809 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.856 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -88.39 159.81 17.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.152 0.501 . . . . 0.0 110.631 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.419 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.66 -62.77 1.29 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.87 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.742 HD21 HG21 ' A' ' 77' ' ' ILE . 29.7 tp -64.43 -40.8 96.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.481 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.856 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.03 -46.4 52.92 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 120.589 0.233 . . . . 0.0 110.393 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 44.6 m -55.89 -46.73 78.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -66.79 -27.92 67.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.465 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.3 mt -77.06 -52.13 9.86 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.686 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.62 -36.37 80.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.051 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -67.36 -33.76 75.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.202 0.525 . . . . 0.0 109.649 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.748 HG23 HD11 ' A' ' 15' ' ' ILE . 98.6 m -61.22 -55.79 28.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.588 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -68.21 -20.67 64.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.883 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -79.21 -45.58 19.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.908 0.385 . . . . 0.0 110.876 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 3.2 mp0 -104.96 9.87 34.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.628 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -149.75 -9.36 0.3 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.441 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 69.93 0.94 29.76 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.01 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.634 HD13 HG11 ' A' ' 103' ' ' VAL . 1.3 mt -106.3 130.81 57.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 117.087 0.444 . . . . 0.0 110.913 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -113.24 172.85 6.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.95 -30.01 32.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.869 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.99 -10.84 78.35 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.162 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 8.4 mm100 -112.74 -14.46 13.11 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.1 -178.69 3.93 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.281 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.564 ' H ' ' H ' ' A' ' 102' ' ' GLU . 9.6 m -124.31 101.71 7.32 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.581 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.742 HG21 HD21 ' A' ' 57' ' ' LEU . 11.7 mm -78.0 123.59 35.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.69 179.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.553 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -87.97 136.88 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 0.0 111.372 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -94.54 151.29 19.46 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.939 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.34 -26.7 22.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.9 t80 -98.83 132.62 44.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.542 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -158.26 133.59 8.73 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.187 0.517 . . . . 0.0 111.388 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -160.21 143.13 13.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.739 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.872 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -129.65 128.53 42.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.932 0.396 . . . . 0.0 111.118 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.4 mt -89.99 118.25 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.222 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.422 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 6.0 m-20 -111.07 124.46 52.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.502 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.409 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 16.6 p90 -167.7 141.34 3.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.257 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.589 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.3 p -83.89 111.22 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.369 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.01 -102.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.796 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -64.07 -35.65 81.43 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.77 0.319 . . . . 0.0 111.01 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 2.6 p-10 173.19 30.72 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.856 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.847 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.92 126.09 2.63 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.78 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.912 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.3 Cg_endo -72.43 119.28 6.03 Favored 'Trans proline' 0 CA--C 1.512 -0.601 0 C-N-CA 123.136 2.557 . . . . 0.0 112.455 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.538 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -100.49 130.2 46.54 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.528 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.1 m -97.03 101.53 13.12 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.72 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 40.2 t -103.33 108.33 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.784 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.872 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.66 122.74 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.665 ' HB3' HG13 ' A' ' 14' ' ' ILE . 25.3 m-85 -110.66 128.18 55.59 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.184 0.516 . . . . 0.0 112.001 -178.034 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.618 ' CD2' HD13 ' A' ' 57' ' ' LEU . 10.9 m-90 -108.06 169.31 8.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.766 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.608 HD13 ' HG ' ' A' ' 147' ' ' LEU . 2.2 mt -101.52 109.06 20.8 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.621 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -118.75 151.73 37.48 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.093 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.564 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tm-20 -131.3 115.16 15.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.12 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.636 HG12 HD23 ' A' ' 75' ' ' LEU . 6.0 m -71.97 131.44 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.291 0.567 . . . . 0.0 110.632 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 74' ' ' GLN . 4.7 mttt -67.81 -26.04 65.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.178 -178.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.755 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 58.4 t0 -104.16 125.14 50.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.951 0.405 . . . . 0.0 112.047 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -62.24 -42.84 99.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.892 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.9 23.2 9.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.743 178.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.5 p -43.49 148.08 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.326 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.604 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -62.95 140.98 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.31 0.576 . . . . 0.0 111.745 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 33.0 mm -124.23 96.75 4.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.692 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -99.42 101.43 12.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.855 -178.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.719 HD11 ' HD1' ' A' ' 119' ' ' TYR . 9.2 mt -97.09 125.04 41.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.297 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.6 p -65.25 -164.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.422 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -80.29 13.96 2.16 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.676 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -104.54 -35.4 7.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.015 0.436 . . . . 0.0 110.68 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.528 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 42.0 m80 -107.25 123.32 48.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.608 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -92.5 -13.41 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.586 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -164.23 167.67 19.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.107 0.48 . . . . 0.0 111.761 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.8 p90 -146.63 168.54 21.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.512 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.433 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 18.8 mtt180 -156.08 156.55 34.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.136 0.493 . . . . 0.0 111.553 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.506 ' CE2' HD13 ' A' ' 32' ' ' LEU . 89.1 m95 -119.66 107.52 13.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.592 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.17 167.73 21.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.856 0.36 . . . . 0.0 111.601 -178.451 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -162.2 11.17 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.702 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 8.3 tp -67.92 -45.58 73.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.809 0.305 . . . . 0.0 111.048 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.4 pt-20 -55.14 -53.39 56.49 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.556 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.721 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -68.81 -51.89 35.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.018 0.437 . . . . 0.0 109.84 179.659 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.25 -27.46 9.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.489 . . . . 0.0 109.782 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 124' ' ' LEU . 0.2 OUTLIER -83.0 -33.25 26.59 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.742 178.428 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.636 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -64.7 -45.83 84.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.788 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.666 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -77.4 -36.98 52.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.199 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.82 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.67 49.66 1.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.648 179.123 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.77 -30.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.066 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.0 127.19 30.59 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.58 -56.59 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.001 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.971 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.77 -50.17 26.43 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.089 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.82 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.36 -36.51 75.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.497 -179.433 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -62.13 -32.61 73.22 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.773 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.09 -46.3 35.54 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.699 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.65 -44.66 66.28 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.052 0.454 . . . . 0.0 110.527 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.72 -24.83 41.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.435 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.563 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.06 -52.11 46.21 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.523 -179.469 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -72.66 -30.85 64.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.44 -47.27 84.59 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.742 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.523 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -75.0 -35.11 62.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.085 0.469 . . . . 0.0 110.17 179.296 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -65.09 -52.94 52.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.686 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -63.89 -53.78 45.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 111.159 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.637 HD13 ' CZ ' ' A' ' 16' ' ' PHE . 94.9 mt -55.86 -28.54 57.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.737 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 41.2 t -73.72 -8.37 55.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.522 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.62 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.899 0.381 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -111.88 133.99 53.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.178 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.687 ' HB3' HG13 ' A' ' 50' ' ' VAL . 3.6 ttt-85 -79.53 119.85 23.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.476 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.471 ' HB2' ' CG ' ' A' ' 94' ' ' LYS . . . -132.49 163.46 28.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.109 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 46.1 m -156.24 123.85 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.056 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.64 174.06 15.07 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.75 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.725 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -124.95 118.15 25.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.126 0.463 . . . . 0.0 111.872 -179.229 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.909 HD11 ' HB1' ' A' ' 139' ' ' ALA . 52.3 mt -82.44 91.68 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.952 HD11 HG23 ' A' ' 64' ' ' THR . 25.8 mt -83.75 146.46 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.1 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.657 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.45 122.68 7.16 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.657 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.546 ' CZ ' ' HG3' ' A' ' 30' ' ' GLU . 1.2 ppt_? -83.29 112.86 20.27 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.014 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.471 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 5.3 ttp180 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.401 -179.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 121.0 0.429 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.657 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -116.09 137.28 50.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.178 0.513 . . . . 0.0 111.866 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.606 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -136.12 126.81 27.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.468 179.196 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.5 m-85 -86.75 147.41 25.86 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.5 tp -84.04 133.08 34.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.676 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.7 mt -134.32 137.25 44.07 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.951 0.405 . . . . 0.0 110.815 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' HG3' ' A' ' 46' ' ' PRO . 2.2 mt -120.73 105.09 10.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.634 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 1.7 tt0 -59.49 132.77 55.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.212 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 42' ' ' HIS . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.42 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.475 ' CE1' ' HB2' ' A' ' 36' ' ' ALA . 6.9 p80 . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.785 0.326 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 81.0 m95 -120.2 101.99 8.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.638 179.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.454 HG23 ' ND1' ' A' ' 42' ' ' HIS . 71.5 p -126.37 154.32 74.85 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.563 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.548 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 63.4 Cg_endo -70.27 173.88 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.408 2.072 . . . . 0.0 111.969 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.704 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.9 Cg_exo -63.93 86.93 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.517 2.145 . . . . 0.0 112.082 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.58 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 1.2 pttt -96.21 152.26 18.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 111.054 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.14 -177.87 15.88 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.889 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.469 ' CD2' ' HD2' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -107.0 115.92 31.02 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 110.504 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.687 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -90.42 128.84 42.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 121.241 0.543 . . . . 0.0 111.179 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 3.0 tt0 -92.06 153.51 43.3 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.799 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 5.2 Cg_endo -47.7 -43.21 29.06 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.968 2.445 . . . . 0.0 112.432 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.425 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -80.43 -15.21 78.77 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -83.53 164.42 19.82 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.798 0.332 . . . . 0.0 111.258 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.865 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 12.0 t70 -85.22 161.44 19.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.473 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.549 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 1.7 m-20 -72.64 -64.76 0.89 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.606 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.708 HD21 HG21 ' A' ' 77' ' ' ILE . 28.4 tp -63.43 -41.6 98.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.865 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.1 OUTLIER -49.86 -46.3 51.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.512 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.1 m -55.8 -44.87 78.22 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -68.5 -30.06 68.81 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.927 178.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.7 mt -73.14 -52.42 14.25 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.26 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.1 84.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.327 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.58 -34.04 76.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.261 0.553 . . . . 0.0 109.806 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.952 HG23 HD11 ' A' ' 15' ' ' ILE . 39.6 m -59.12 -52.62 64.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.588 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.8 pt20 -74.59 -23.13 58.7 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.2 -35.45 48.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.899 0.38 . . . . 0.0 110.812 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.494 ' HB3' HD13 ' A' ' 34' ' ' LEU . 5.5 mt-10 -109.8 3.05 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.868 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -150.73 -6.97 0.28 Allowed 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.63 2.38 43.47 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 120.071 -1.061 . . . . 0.0 112.618 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.749 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -105.85 128.16 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-O 120.878 0.371 . . . . 0.0 110.301 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 4.4 pm0 -112.19 172.23 7.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.482 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.823 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.67 -31.97 39.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.999 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.79 -6.42 81.76 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.175 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.63 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -112.88 -14.36 13.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.548 0.213 . . . . 0.0 110.968 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.86 -171.07 2.21 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.6 m -130.91 98.78 4.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.251 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.708 HG21 HD21 ' A' ' 57' ' ' LEU . 12.3 mm -73.22 122.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.037 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.693 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -85.28 135.58 24.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -92.97 151.43 19.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.267 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.71 -23.18 37.09 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.524 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.702 ' CD1' HD21 ' A' ' 100' ' ' LEU . 19.8 t80 -102.13 126.11 49.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.841 0.353 . . . . 0.0 110.917 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.468 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.2 ttpt -158.1 125.18 4.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.191 0.52 . . . . 0.0 111.306 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.9 137.54 23.76 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.612 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.827 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.08 127.5 51.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.991 0.424 . . . . 0.0 111.496 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.976 HD13 ' HB2' ' A' ' 135' ' ' GLU . 6.7 mt -92.73 117.34 29.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.225 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.629 HD21 HG23 ' A' ' 95' ' ' THR . 2.0 m-80 -107.02 123.76 48.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.3 -178.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 25.5 p90 -166.88 143.48 4.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.16 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.592 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.0 p -84.31 111.42 20.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.541 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.4 -106.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.241 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -41.55 88.47 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.927 0.394 . . . . 0.0 110.763 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 177.9 29.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.732 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.791 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -155.48 125.84 3.38 Favored Pre-proline 0 N--CA 1.452 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.562 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.53 119.99 6.77 Favored 'Trans proline' 0 CA--C 1.513 -0.544 0 C-N-CA 123.179 2.586 . . . . 0.0 112.481 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.471 ' CG ' ' HB2' ' A' ' 10' ' ' ALA . 6.0 ttpt -106.89 119.02 38.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.96 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.629 HG23 HD21 ' A' ' 86' ' ' ASN . 47.7 m -82.19 107.74 15.12 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.735 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 46.3 t -104.28 107.97 23.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.914 -178.268 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.827 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.47 131.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.657 ' HB3' HG13 ' A' ' 14' ' ' ILE . 6.1 m-85 -116.24 136.74 52.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.287 0.565 . . . . 0.0 112.135 -177.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.549 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 8.9 m-90 -125.01 140.91 52.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.238 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -74.76 132.21 41.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.709 -0.396 . . . . 0.0 109.936 179.171 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -141.15 135.75 31.16 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.821 0.343 . . . . 0.0 111.549 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.8 tm-20 -113.55 115.8 28.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.257 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.763 HG12 HD23 ' A' ' 75' ' ' LEU . 16.3 m -71.89 122.25 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-O 121.159 0.504 . . . . 0.0 110.447 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -64.05 -22.34 66.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.661 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.912 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -100.91 111.46 23.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.27 0.557 . . . . 0.0 111.711 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -56.69 -39.14 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.65 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -105.76 28.07 7.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.551 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.912 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.3 p -48.18 149.08 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.699 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.438 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 2.1 pm0 -72.24 144.0 48.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 110.577 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.774 HG21 ' CG ' ' A' ' 119' ' ' TYR . 37.6 mm -121.66 94.59 3.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.659 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.473 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.3 OUTLIER -97.59 98.61 10.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.715 -179.405 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.686 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.0 mt -83.09 174.64 10.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HG2' ' A' ' 115' ' ' GLU . 24.7 p -116.18 -167.72 1.32 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -59.94 -43.48 94.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.997 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.401 ' HG2' ' OG ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -69.37 -4.52 18.68 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.495 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.45 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 27.5 m170 -120.99 144.45 48.5 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 111.314 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -127.53 -18.12 4.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.628 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.72 154.89 18.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.939 0.399 . . . . 0.0 111.421 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.774 ' CG ' HG21 ' A' ' 110' ' ' ILE . 37.8 p90 -136.65 168.15 20.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.41 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 119' ' ' TYR . 6.7 mtt180 -156.19 159.85 39.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.134 0.492 . . . . 0.0 111.598 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.3 m95 -121.33 109.28 14.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.644 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.32 168.33 19.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.028 0.442 . . . . 0.0 111.623 -178.712 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.56 -153.34 3.28 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.714 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.506 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.1 tp -77.13 -43.15 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.808 0.337 . . . . 0.0 111.063 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -59.19 -48.9 79.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.837 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.67 -41.0 63.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.933 0.397 . . . . 0.0 110.851 -179.376 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.58 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -61.22 -29.56 69.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.263 0.554 . . . . 0.0 109.515 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.3 -33.5 23.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.502 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.823 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.71 -42.73 95.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.636 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.621 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -77.35 -43.12 34.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.71 57.71 2.58 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.73 178.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -37.5 -36.94 0.18 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.929 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.531 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 6.9 m-85 -54.62 118.98 4.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.766 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.09 -51.95 12.95 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.106 0.479 . . . . 0.0 110.605 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.976 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -50.95 -53.35 33.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.564 179.917 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.761 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.74 -37.17 78.24 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -61.25 -34.95 76.0 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.74 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.65 -46.17 55.33 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.895 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.909 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.74 -45.71 63.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.099 0.475 . . . . 0.0 110.004 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.58 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -76.39 -29.69 57.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 178.92 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.567 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -66.22 -52.45 47.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.171 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -69.35 -30.63 68.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.252 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.441 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.16 -44.67 88.74 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.657 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 3.5 t-80 -78.19 -34.23 49.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.748 0.309 . . . . 0.0 110.351 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -61.82 -52.77 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.482 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.64 -50.43 69.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.105 0.479 . . . . 0.0 110.694 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.539 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.4 mt -57.21 -34.65 68.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.791 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -73.5 -17.48 61.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.697 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.718 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.745 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.636 0.731 . . . . 0.93999999999999995 109.907 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.059 HD13 ' HG2' ' A' ' 94' ' ' LYS . 1.0 OUTLIER -72.26 125.73 28.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.655 -1.157 . . . . 0.95999999999999996 111.618 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.476 ' HB3' HG13 ' A' ' 50' ' ' VAL . 4.9 ttt180 -78.47 111.53 14.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 2.6200000000000001 110.057 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -129.02 168.38 16.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.776 -0.647 . . . . 0.71999999999999997 110.796 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.457 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.1 m -157.11 122.41 4.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.68000000000000005 110.905 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.99 171.98 14.09 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.557 -0.747 . . . . 0.45000000000000001 111.421 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.476 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -126.61 117.11 22.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.987 0.394 . . . . 0.35999999999999999 111.103 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.903 HD11 ' HB1' ' A' ' 139' ' ' ALA . 84.3 mt -82.79 91.2 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.091 -1.077 . . . . 0.56000000000000005 108.091 177.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.868 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -78.44 145.39 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 114.913 -1.04 . . . . 0.29999999999999999 111.087 -178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.5 p90 -149.12 121.38 8.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 123.431 0.457 . . . . 1.26 111.49 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.94 111.64 17.59 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.791 -0.448 . . . . 4.3200000000000003 109.791 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.234 0.241 0 CA-C-N 116.107 -0.497 . . . . 2.6400000000000001 111.247 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.649 0.261 . . . . 0.72999999999999998 110.971 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.702 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.8 mt -121.4 135.31 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.51000000000000001 111.389 -179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.3 120.93 28.07 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.087 -0.506 . . . . 1.9099999999999999 110.248 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 47.1 m-85 -82.1 149.62 27.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 1.27 112.209 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.633 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 52.4 tp -87.18 134.07 33.57 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.743 -0.662 . . . . 0.27000000000000002 110.032 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.557 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.2 mt -133.69 134.64 43.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.34 -0.391 . . . . 0.34000000000000002 111.085 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 46' ' ' PRO . 20.7 mt -113.0 113.43 25.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.074 -0.512 . . . . 0.45000000000000001 110.803 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -69.62 144.35 53.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.892 -0.594 . . . . 1.6899999999999999 111.606 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.236 0 CA-C-N 115.972 -0.558 . . . . 1.1599999999999999 110.362 179.086 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.775 0.321 . . . . 1.2 110.834 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.557 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 56.8 m95 -95.03 122.59 37.85 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.079 -0.509 . . . . 0.65000000000000002 110.852 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -145.17 144.68 24.25 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.003 -0.544 . . . . 0.66000000000000003 110.9 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.48 171.61 3.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.775 2.316 . . . . 0.75 112.221 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.627 ' HG3' HD11 ' A' ' 34' ' ' LEU . 19.8 Cg_exo -65.04 101.86 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.626 2.217 . . . . 0.60999999999999999 112.264 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.14 142.87 30.07 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.207 -0.452 . . . . 1.8500000000000001 110.97 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -128.55 176.71 18.13 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.104 -0.57 . . . . 0.77000000000000002 112.56 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.1 103.89 12.68 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.726 0.298 . . . . 2.71 110.63 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.602 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -79.31 121.43 32.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 121.113 0.483 . . . . 0.93000000000000005 111.106 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.41 158.38 54.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.5 -0.773 . . . . 1.98 109.978 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.73 -53.59 6.34 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.927 2.418 . . . . 1.3999999999999999 112.453 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.84 -13.24 83.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 121.014 -0.612 . . . . 1.1799999999999999 113.189 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -81.87 155.33 25.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.884 0.342 . . . . 1.4299999999999999 111.114 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 34.9 t70 -79.27 158.3 27.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.244 -0.434 . . . . 1.3300000000000001 110.702 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.465 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -69.3 -62.32 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.852 -0.613 . . . . 1.74 111.598 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.736 HD21 HG21 ' A' ' 77' ' ' ILE . 9.1 tp -62.51 -40.23 96.06 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.789 -0.187 . . . . 0.60999999999999999 111.485 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.84 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -51.6 -40.76 60.43 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.972 0.17 . . . . 1.9099999999999999 110.692 179.657 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.602 HG21 ' N ' ' A' ' 50' ' ' VAL . 96.3 m -61.9 -46.96 87.09 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 110.057 -0.349 . . . . 0.63 110.057 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.24 -43.23 99.31 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 109.63 -0.507 . . . . 0.47999999999999998 109.63 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.85 HD22 ' HB2' ' A' ' 72' ' ' ALA . 97.9 mt -60.39 -52.77 63.81 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.371 -0.831 . . . . 0.5 110.901 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -42.62 85.86 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.868 -0.606 . . . . 2.79 110.809 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.44 -35.64 79.89 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.29 -0.413 . . . . 0.44 111.098 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.868 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -63.99 -43.28 96.17 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.192 -0.458 . . . . 0.34000000000000002 111.208 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.584 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 3.9 pt20 -80.08 -24.64 40.48 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.536 0.199 . . . . 1.71 111.536 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -79.93 -46.05 17.43 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.695 -0.23 . . . . 1.77 111.465 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 21.9 mt-10 -97.81 -11.45 23.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.679 0.622 . . . . 2.0 112.679 -179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -131.96 -3.46 3.6 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.83 0.678 . . . . 0.37 112.83 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 69.65 6.34 54.77 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.391 -0.909 . . . . 0.37 113.546 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.606 ' O ' HG22 ' A' ' 64' ' ' THR . 2.4 mt -111.09 120.12 61.07 Favored 'Isoleucine or valine' 0 C--N 1.341 0.23 0 CA-C-N 117.378 0.589 . . . . 0.34000000000000002 111.346 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.6 pt-20 -97.0 172.27 7.96 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 1.8200000000000001 110.642 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -50.68 -42.01 56.36 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.998 0.37 . . . . 0.45000000000000001 111.998 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.78 -25.7 71.87 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 120.998 -0.62 . . . . 0.47999999999999998 112.742 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.534 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 5.9 tp60 -86.87 2.86 47.72 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 111.773 0.286 . . . . 1.54 111.773 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.841 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -139.48 -164.34 1.66 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.663 0.268 . . . . 0.44 110.5 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.436 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.4 m -143.02 100.85 3.72 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.331 -0.395 . . . . 0.51000000000000001 110.168 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.736 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -75.11 118.06 20.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.99 -0.55 . . . . 0.55000000000000004 111.414 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.596 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -78.7 136.93 22.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.712 -0.677 . . . . 0.56999999999999995 110.682 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.99 146.96 23.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.423 -0.808 . . . . 1.5 111.129 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.98 -28.36 15.61 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.822 -0.704 . . . . 0.75 113.063 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD21 ' A' ' 100' ' ' LEU . 37.9 t80 -98.88 128.91 45.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.3400000000000001 111.633 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -158.25 126.87 5.48 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.707 -0.679 . . . . 1.4099999999999999 110.655 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -152.01 129.57 11.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.586 . . . . 3.0099999999999998 110.75 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.739 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -110.74 137.49 48.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.886 0.374 . . . . 1.4199999999999999 111.248 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.973 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.8 mt -102.2 121.61 42.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.781 -0.645 . . . . 0.68999999999999995 110.553 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.478 HD21 HG23 ' A' ' 95' ' ' THR . 4.7 m-80 -110.27 127.26 54.91 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.301 -0.409 . . . . 1.75 111.773 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.417 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 14.5 p90 -167.3 141.6 3.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.788 -0.642 . . . . 1.48 111.428 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.55 ' O ' HG13 ' A' ' 88' ' ' VAL . 9.9 p -82.77 112.6 20.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.49 -0.559 . . . . 0.91000000000000003 109.49 177.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.76 -91.56 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.34 -0.391 . . . . 0.90000000000000002 111.38 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -82.69 -44.76 15.3 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.877 0.37 . . . . 3.5 110.09 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -169.95 31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.869 -0.605 . . . . 2.2799999999999998 111.0 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.989 ' HB3' HD11 ' A' ' 8' ' ' LEU . 8.7 tptt -161.16 126.19 2.17 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.981 0.42 . . . . 2.21 110.904 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.876 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.6 Cg_endo -66.41 121.34 8.59 Favored 'Trans proline' 0 N--CA 1.476 0.457 0 C-N-CA 123.745 2.963 . . . . 0.91000000000000003 112.715 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 1.059 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -101.69 121.33 41.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.002 -0.545 . . . . 1.5800000000000001 111.713 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.478 HG23 HD21 ' A' ' 86' ' ' ASN . 90.1 m -92.76 106.25 18.25 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.93 -0.767 . . . . 0.82999999999999996 108.93 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.0 t -107.01 106.46 20.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 111.735 0.272 . . . . 0.67000000000000004 111.735 -178.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.739 HD13 ' HB3' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -87.0 124.63 40.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.259 -0.645 . . . . 0.75 109.259 178.517 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.512 ' HB3' HG13 ' A' ' 14' ' ' ILE . 45.5 m-85 -109.01 158.04 18.1 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.876 0.695 . . . . 1.28 112.876 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.474 ' CD2' HD13 ' A' ' 57' ' ' LEU . 15.2 m-90 -141.39 157.98 44.47 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 114.762 -1.108 . . . . 0.71999999999999997 109.82 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.596 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 2.0 mt -92.63 108.29 19.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.679 0.276 . . . . 0.54000000000000004 110.261 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.535 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -117.97 125.29 50.11 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.432 -0.349 . . . . 0.34999999999999998 110.645 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CZ ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -104.93 113.89 27.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 1.3799999999999999 111.093 -179.377 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.841 HG12 HD23 ' A' ' 75' ' ' LEU . 10.2 m -72.61 125.63 31.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 121.127 0.489 . . . . 0.53000000000000003 110.404 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.503 ' HE2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -70.37 -16.49 62.98 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.667 -0.697 . . . . 1.4399999999999999 112.646 -178.338 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.753 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 1.1 t70 -105.05 129.85 53.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.757 0.313 . . . . 2.3900000000000001 111.042 179.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.4 -41.04 73.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 2.98 109.932 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.83 32.07 3.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.785 -0.643 . . . . 2.29 110.325 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.6 p -52.14 140.61 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 115.93 -0.577 . . . . 0.58999999999999997 110.33 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -62.0 140.65 58.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.259 0.552 . . . . 1.26 111.693 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.782 HG21 ' CG ' ' A' ' 119' ' ' TYR . 41.4 mm -120.39 98.84 6.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.245 -0.889 . . . . 0.46000000000000002 110.012 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 5.4 mtt180 -101.01 98.48 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.532 -0.758 . . . . 3.2000000000000002 110.844 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.705 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.4 mt -87.67 146.0 25.9 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.589 -0.732 . . . . 0.75 111.73 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.2 m -91.07 -172.35 3.29 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.709 -0.678 . . . . 1.55 110.718 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -60.28 -28.77 68.35 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.718 -0.219 . . . . 2.7599999999999998 111.531 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.75 -44.52 73.58 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 111.798 0.295 . . . . 2.6299999999999999 111.798 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -104.34 123.75 47.96 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 1.3200000000000001 111.498 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -95.42 -26.34 15.9 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.076 -0.511 . . . . 2.6800000000000002 111.814 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -141.61 168.12 20.52 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.03 0.443 . . . . 0.64000000000000001 111.654 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.782 ' CG ' HG21 ' A' ' 110' ' ' ILE . 31.5 p90 -148.24 161.78 40.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.71 -0.677 . . . . 1.3300000000000001 110.635 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -153.78 153.97 33.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.139 0.495 . . . . 2.0499999999999998 111.655 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.561 ' CE2' HD13 ' A' ' 32' ' ' LEU . 82.9 m95 -117.28 106.94 13.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.256 -0.884 . . . . 0.46000000000000002 109.049 178.6 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.42 168.77 18.59 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.938 0.399 . . . . 0.45000000000000001 111.829 -178.117 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.48 -158.13 6.95 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.835 -0.621 . . . . 0.42999999999999999 112.209 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.4 tp -72.71 -45.79 56.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.596 0.198 . . . . 0.5 111.17 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.6 pt-20 -58.36 -48.65 79.9 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.128 0.418 . . . . 1.3400000000000001 112.128 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.03 -42.09 60.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.689 -0.232 . . . . 1.28 111.041 -179.465 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.557 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.99 -31.01 69.51 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.844 -0.428 . . . . 0.37 109.844 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.65 -37.56 35.7 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.62 -0.718 . . . . 1.46 110.263 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -59.47 -42.67 92.57 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.402 -0.363 . . . . 1.29 111.042 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.598 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -78.22 -42.51 31.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.348 -0.387 . . . . 0.51000000000000001 110.849 179.174 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.793 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.04 56.41 1.98 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.202 0.525 . . . . 0.5 109.858 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.31 -39.48 0.28 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.824 -1.08 . . . . 2.5299999999999998 111.951 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.443 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 56.5 m-85 -56.08 120.39 7.41 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.18 -0.464 . . . . 1.51 109.877 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -57.21 4.35 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.931 0.715 . . . . 1.8600000000000001 112.931 -177.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.973 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.58 -47.2 28.61 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.177 0.298 . . . . 1.71 111.391 -179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.793 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.07 -46.75 87.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.196 -0.298 . . . . 0.62 110.196 179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -40.92 72.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.893 -0.594 . . . . 1.4099999999999999 110.078 178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.523 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.8 -41.88 74.47 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-N 115.97 -0.559 . . . . 0.56999999999999995 111.143 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.903 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.51 -46.89 80.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.95 0.405 . . . . 0.48999999999999999 109.967 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.5 mt -71.76 -31.16 66.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.625 -0.716 . . . . 0.40999999999999998 110.042 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.3 OUTLIER -65.89 -51.75 56.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.918 -0.583 . . . . 1.1899999999999999 111.187 179.579 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.56 -31.7 71.11 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.097 -0.501 . . . . 2.2799999999999998 110.928 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -60.2 -46.09 94.87 Favored Glycine 0 C--N 1.338 0.662 0 C-N-CA 120.786 -0.721 . . . . 0.48999999999999999 111.655 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -72.12 -36.09 69.31 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.551 0.215 . . . . 1.3799999999999999 110.537 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -64.7 -52.71 55.72 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.276 -0.42 . . . . 1.47 111.441 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -56.66 -51.38 68.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.084 -0.507 . . . . 1.3600000000000001 111.065 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.544 ' CD2' HG12 ' A' ' 78' ' ' ILE . 87.5 mt -59.13 -37.26 76.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.112 -0.494 . . . . 0.64000000000000001 111.671 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 2.0 t -70.45 -19.33 62.97 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.615 0.245 . . . . 1.04 110.72 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-N 116.372 -0.376 . . . . 1.01 111.503 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.984 0.421 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.906 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.47 126.17 54.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.517 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.812 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.8 OUTLIER -78.19 123.82 27.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 48' ' ' GLY . . . -142.83 160.03 41.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.122 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.476 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 80.0 m -150.72 123.79 8.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.176 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.578 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -111.74 177.25 18.74 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -130.26 118.18 20.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.589 0.695 . . . . 0.0 112.328 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.724 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.8 mt -82.64 91.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 27.5 mt -81.51 145.9 8.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.339 -178.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.649 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 35.5 p90 -152.94 127.27 9.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.372 -178.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.503 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.08 113.02 23.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.006 0.431 . . . . 0.0 110.119 178.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.466 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.906 0.384 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.581 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.8 mt -102.39 149.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.705 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.649 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.8 mp0 -116.7 172.65 7.09 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.036 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 27.9 m-85 -135.14 129.11 33.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.564 0.221 . . . . 0.0 111.14 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -71.95 133.08 45.15 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.593 HD22 ' HB3' ' A' ' 43' ' ' TRP . 4.0 mt -133.99 144.74 48.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.729 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 112' ' ' LEU . 51.7 mt -123.41 109.73 14.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.065 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.488 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 5.1 tt0 -72.62 143.38 48.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.423 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.636 179.254 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 . . . . . 0 CA--C 1.522 -0.133 0 CA-C-O 120.783 0.325 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.682 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.8 m95 -103.91 140.93 37.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.305 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.691 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -163.43 141.8 6.22 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.901 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.5 Cg_endo -66.42 169.11 14.68 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.367 2.044 . . . . 0.0 111.896 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.607 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 51.7 Cg_exo -51.69 103.98 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.594 2.196 . . . . 0.0 112.644 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.61 124.05 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.967 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.26 169.68 13.39 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.322 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -118.25 104.84 11.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.702 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.812 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.56 129.29 37.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.425 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.655 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -91.48 177.36 2.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.408 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.655 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.5 Cg_exo -57.34 -54.2 3.81 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.402 2.068 . . . . 0.0 112.87 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.23 3.73 86.56 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.373 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 21.6 tt0 -84.43 171.24 12.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.901 0.35 . . . . 0.0 110.736 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.884 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.7 t70 -97.06 157.73 15.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.273 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.543 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 12.9 m-20 -70.04 -64.92 0.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.281 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 22.7 tp -62.79 -42.93 99.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.113 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.884 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -49.35 -43.08 43.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.543 -179.794 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 25.9 m -58.56 -45.26 89.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.04 -30.04 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.823 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.756 HD22 ' HB2' ' A' ' 72' ' ' ALA . 88.4 mt -72.93 -51.85 16.91 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.118 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -41.71 95.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.802 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.502 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -61.39 -39.57 91.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.173 0.511 . . . . 0.0 109.826 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -58.18 -47.03 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.891 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.476 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 13.2 pt20 -80.0 -25.15 40.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.978 0.418 . . . . 0.0 110.484 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -30.06 50.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.718 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 69.2 mm-40 -107.68 -27.07 10.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.772 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -121.8 -7.93 8.98 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.895 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 79.49 -8.87 45.33 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 119.712 -1.232 . . . . 0.0 112.77 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.675 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.6 mt -93.82 132.71 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 120.866 0.365 . . . . 0.0 110.468 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pt-20 -116.52 170.18 8.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.21 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.5 -39.53 10.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.47 -21.66 68.89 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.435 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.444 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 7.1 tp60 -100.66 -3.39 30.42 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.03 -170.9 2.55 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 178.211 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.573 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 57.4 m -136.36 98.18 3.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 111.617 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.575 HG21 ' CD2' ' A' ' 57' ' ' LEU . 5.7 mm -69.28 127.89 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.137 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -92.43 137.76 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -97.98 151.3 20.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.126 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.11 -31.22 8.9 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.975 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.789 ' CE1' HD21 ' A' ' 100' ' ' LEU . 10.3 t80 -103.64 105.17 15.32 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 120.894 0.378 . . . . 0.0 110.72 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -135.68 122.35 20.94 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.339 0.59 . . . . 0.0 110.639 179.589 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -140.9 148.33 40.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.917 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.866 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.8 pm0 -133.06 125.36 29.45 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.431 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.902 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.2 mt -91.95 116.68 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.046 179.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.81 129.92 56.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.829 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -166.75 141.76 4.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 92' ' ' LYS . 7.7 p -81.99 111.42 18.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.847 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.48 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.887 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -37.47 18.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.066 0.46 . . . . 0.0 110.932 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 177.64 26.44 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.534 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.785 ' HB3' HD11 ' A' ' 8' ' ' LEU . 2.7 tptt -155.11 120.85 2.62 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.848 ' O ' HD12 ' A' ' 8' ' ' LEU . 43.4 Cg_endo -68.73 117.84 5.27 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.372 2.715 . . . . 0.0 113.053 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.906 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -100.58 115.46 30.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.985 -179.356 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 48.0 m -86.28 120.75 27.97 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.715 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.2 t -116.67 108.12 24.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.014 -0.275 . . . . 0.0 111.692 -178.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.866 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -84.52 125.63 40.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.535 ' HB3' ' CD1' ' A' ' 14' ' ' ILE . 9.4 m-85 -113.15 130.75 56.1 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.144 -177.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.547 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.7 m-90 -114.9 156.86 24.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.698 178.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.789 HD21 ' CE1' ' A' ' 81' ' ' PHE . 2.1 mt -93.18 113.13 25.28 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.573 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -124.81 148.94 47.9 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.966 0.412 . . . . 0.0 111.788 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.603 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.2 OUTLIER -123.38 117.94 26.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.129 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.706 HG12 HD23 ' A' ' 75' ' ' LEU . 7.6 m -71.94 132.61 33.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.853 0.358 . . . . 0.0 110.367 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.85 -20.68 66.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.702 -178.283 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.724 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 60.3 t0 -111.89 120.57 42.38 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 8.1 t80 -58.98 -38.12 78.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.353 178.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -105.69 26.1 9.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.996 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.724 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.6 p -43.3 149.02 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.456 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.583 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -70.21 142.93 52.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.222 0.535 . . . . 0.0 111.298 -179.099 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.832 HG21 ' CG ' ' A' ' 119' ' ' TYR . 46.1 mm -120.15 99.67 7.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.758 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.895 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 3.9 mtp180 -98.77 100.4 11.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.913 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 34' ' ' LEU . 14.0 mt -90.3 153.7 20.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.77 -166.84 1.13 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.0 m80 -68.21 -1.45 6.16 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.37 -27.65 18.21 Favored 'General case' 0 C--N 1.335 -0.051 0 CA-C-O 120.838 0.351 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.543 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 23.5 m80 -127.15 141.38 51.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.689 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -100.58 -17.64 16.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.082 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.44 169.44 13.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.971 0.415 . . . . 0.0 111.515 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.832 ' CG ' HG21 ' A' ' 110' ' ' ILE . 35.9 p90 -140.42 174.96 10.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.112 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.56 163.07 33.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.313 0.578 . . . . 0.0 111.682 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.485 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 72.4 m95 -128.83 107.67 9.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.047 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -142.43 166.68 24.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.18 0.514 . . . . 0.0 111.819 -178.185 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.32 -151.34 1.72 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.313 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.543 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.1 tp -76.98 -47.19 21.47 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.923 0.392 . . . . 0.0 111.19 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -56.88 -51.79 67.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.787 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.96 -48.93 61.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.949 0.404 . . . . 0.0 110.787 -179.086 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.484 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -54.66 -29.24 52.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.323 0.582 . . . . 0.0 109.926 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.1 m -84.46 -32.58 23.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.407 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.822 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.64 -43.56 84.31 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.808 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.682 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.1 mt -77.42 -42.91 34.38 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.2 51.86 1.24 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.466 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.93 -29.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.707 -179.194 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.476 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 13.7 m-85 -60.47 119.84 8.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.327 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.48 -48.37 19.1 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.876 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.902 ' HB3' HD13 ' A' ' 85' ' ' LEU . 34.0 mp0 -48.16 -54.58 12.89 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.666 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.691 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -65.13 -42.17 94.13 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.33 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.61 -39.32 61.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.059 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.552 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.28 -46.75 60.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.771 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.4 -49.76 60.95 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.665 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.509 HD12 ' O ' ' A' ' 136' ' ' MET . 0.3 OUTLIER -72.94 -32.02 64.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.953 178.876 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.552 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 2.4 mm-40 -59.66 -52.29 66.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.432 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 3.0 mt-10 -71.55 -27.48 63.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.949 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.98 -42.73 92.97 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.894 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -76.27 -36.58 58.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.016 0.436 . . . . 0.0 110.22 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -63.48 -52.6 60.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.05 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -65.33 -51.95 57.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.463 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.449 ' HG ' HD13 ' A' ' 100' ' ' LEU . 75.5 mt -56.96 -25.16 57.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.886 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.4 t -78.39 -18.64 54.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.747 0.308 . . . . 0.0 110.611 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.697 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.109 0.481 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.982 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.24 139.42 44.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.208 179.2 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.862 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtt180 -82.8 125.02 30.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.366 -179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.733 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -137.64 165.93 25.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.991 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -160.59 123.82 3.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.298 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.577 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.02 172.3 14.16 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.72 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.682 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.5 OUTLIER -125.46 117.92 24.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -179.432 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 1.002 HD11 ' HB1' ' A' ' 139' ' ' ALA . 43.2 mt -83.74 92.02 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -82.45 146.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.982 -178.211 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.741 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 53.7 p90 -152.24 121.41 6.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.278 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.5 ptm180 -82.16 114.69 20.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.224 0.535 . . . . 0.0 110.25 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.421 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 23.8 ttp85 . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.248 -179.085 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.07 0 CA-C-O 120.819 0.342 . . . . 0.0 111.404 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.741 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.2 mt -107.64 143.87 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 111.905 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.626 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -132.79 126.84 33.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.104 179.81 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.3 m-85 -89.71 151.68 21.73 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.609 HD23 ' CD1' ' A' ' 15' ' ' ILE . 47.8 tp -86.72 133.99 33.63 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.0 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.577 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.3 mt -135.23 144.33 46.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 112' ' ' LEU . 14.4 mt -123.61 113.24 18.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.086 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.491 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.5 tt0 -74.1 140.48 45.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.209 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.505 179.19 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.694 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 46.6 m95 -98.71 140.79 32.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.67 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.793 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -163.27 142.59 6.66 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 -179.718 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 175.95 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.383 2.055 . . . . 0.0 112.105 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.684 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 6.8 Cg_exo -73.3 102.4 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.851 2.367 . . . . 0.0 112.428 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.7 OUTLIER -110.36 157.59 19.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.393 179.435 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -148.84 173.01 28.89 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.5 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 26.1 t-80 -99.29 110.53 23.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.862 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.92 134.6 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.726 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 8.6 tt0 -90.63 150.99 43.45 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.239 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.5 -21.82 19.78 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.861 2.374 . . . . 0.0 113.033 -178.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.725 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.64 -9.75 42.71 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.337 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -89.64 171.49 9.64 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.607 0.241 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.926 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.9 t70 -87.84 160.98 17.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.046 0.45 . . . . 0.0 110.651 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.588 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 16.7 m-20 -71.52 -58.99 3.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.146 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 77' ' ' ILE . 23.0 tp -65.97 -42.13 90.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.211 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.926 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.82 -42.54 47.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.7 0.286 . . . . 0.0 110.503 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.541 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 98.5 m -60.48 -44.08 96.3 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.17 -30.35 67.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.879 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.847 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.8 mt -71.83 -51.98 19.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.354 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -60.61 -42.35 96.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.593 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 66' ' ' GLU . . . -59.52 -33.58 71.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.178 0.513 . . . . 0.0 109.779 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 66.5 m -59.14 -53.64 56.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.301 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.534 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.7 pt20 -72.6 -20.94 61.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.028 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 1.5 mm-40 -77.96 -40.25 39.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.841 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 59.1 mm-40 -111.34 12.8 21.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.346 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -154.54 -11.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.618 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.05 2.41 46.86 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.291 -0.957 . . . . 0.0 113.123 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.673 ' O ' HG22 ' A' ' 64' ' ' THR . 1.5 mt -105.47 129.65 58.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.815 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.8 pm0 -110.17 172.38 6.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.648 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.27 -36.26 20.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.15 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.68 -18.96 72.65 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.062 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.517 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 4.7 mt-30 -100.76 -5.02 26.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.546 0.213 . . . . 0.0 111.28 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.936 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -132.75 -170.15 2.39 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.417 177.943 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.561 ' H ' ' H ' ' A' ' 102' ' ' GLU . 55.2 m -133.54 100.37 4.78 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.049 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 57' ' ' LEU . 17.7 mm -74.39 123.38 29.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.242 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.592 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -83.32 139.06 18.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -97.88 144.98 26.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.173 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.2 -23.52 31.72 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.884 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.583 ' CE1' HD21 ' A' ' 100' ' ' LEU . 11.0 t80 -103.44 128.55 50.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.155 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.483 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -157.98 130.98 7.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.265 179.485 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -151.99 137.27 17.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.913 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.95 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -120.52 134.07 55.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.134 0.492 . . . . 0.0 112.04 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.9 mt -96.32 121.19 37.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -111.68 123.71 50.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.407 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 27.1 p90 -166.95 141.58 3.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.037 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.582 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.5 p -83.6 112.69 21.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.689 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.7 -97.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.674 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -74.05 -36.29 64.36 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.777 0.322 . . . . 0.0 110.943 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.44 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 1.5 t30 178.98 24.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.218 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.802 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.6 tptt -155.32 126.95 3.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 110.891 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.906 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.3 Cg_endo -69.5 119.89 6.79 Favored 'Trans proline' 0 CA--C 1.515 -0.438 0 C-N-CA 123.437 2.758 . . . . 0.0 112.876 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.982 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.9 mmmt -101.51 129.39 47.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.04 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 24.2 m -95.49 114.62 26.4 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.763 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.4 t -113.75 107.76 23.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.95 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.37 120.33 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.694 ' HB3' HG13 ' A' ' 14' ' ' ILE . 8.5 m-85 -104.17 128.53 51.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.042 0.448 . . . . 0.0 111.705 -178.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.588 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 7.9 m-90 -114.4 152.8 30.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.437 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.583 HD21 ' CE1' ' A' ' 81' ' ' PHE . 1.1 mt -88.59 121.37 30.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.8 144.71 51.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.561 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.9 tt0 -122.83 113.85 19.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.387 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.936 HG12 HD23 ' A' ' 75' ' ' LEU . 17.4 m -72.78 115.45 13.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 121.399 0.619 . . . . 0.0 110.869 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.517 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -60.24 -26.74 66.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.662 -178.949 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.914 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 2.1 m-20 -93.8 110.1 21.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.19 0.519 . . . . 0.0 111.501 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -58.38 -38.49 77.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.09 26.13 9.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.807 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.914 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.9 p -47.85 149.45 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.419 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -73.39 142.31 46.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.134 0.493 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.77 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.9 mm -118.27 99.65 8.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.618 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.1 OUTLIER -103.2 97.96 7.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.127 -179.457 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 34' ' ' LEU . 5.5 mt -84.71 -177.75 6.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.775 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 67' ' ' GLU . 0.3 OUTLIER -120.44 -166.14 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.677 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -68.58 -14.99 63.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.685 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.61 23.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.687 0.279 . . . . 0.0 111.405 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 35.6 m80 -119.76 122.08 40.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.899 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -103.75 -7.67 20.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.601 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -165.7 154.78 11.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.047 0.451 . . . . 0.0 111.24 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.77 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.6 p90 -134.45 171.61 14.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.493 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -157.78 157.82 34.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.211 0.529 . . . . 0.0 111.506 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.581 ' C ' ' HG2' ' A' ' 30' ' ' GLU . 73.3 m95 -122.47 109.55 14.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.521 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.715 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.94 170.67 15.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.007 0.432 . . . . 0.0 111.458 -178.651 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.43 -155.13 4.95 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.075 179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.2 tp -75.17 -41.23 58.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.652 0.263 . . . . 0.0 111.084 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.3 pt-20 -62.3 -51.24 68.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.715 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -70.37 -45.54 65.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.0 0.428 . . . . 0.0 110.479 -179.525 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.577 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -57.73 -29.98 65.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.238 0.542 . . . . 0.0 109.692 178.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 4.2 m -83.91 -32.1 25.3 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.32 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.9 OUTLIER -64.59 -44.27 91.16 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.694 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -77.13 -43.98 32.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.923 179.119 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.27 53.61 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.91 -30.57 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.571 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 12.1 m-85 -60.28 118.49 6.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.426 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -46.4 -46.62 18.69 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.237 0.541 . . . . 0.0 111.693 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.9 mp0 -50.84 -54.46 23.58 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.981 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.793 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.19 -42.62 99.46 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.136 -179.55 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -34.7 40.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 110.148 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.559 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.75 -47.45 25.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.939 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 1.002 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.94 -41.73 62.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.088 0.47 . . . . 0.0 110.207 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.55 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -78.69 -28.18 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.601 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -66.36 -52.02 51.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.05 -32.77 69.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.483 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.07 -39.78 90.29 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.215 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.6 OUTLIER -80.4 -31.25 37.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.863 0.363 . . . . 0.0 110.588 179.652 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.54 -52.55 57.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.366 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.01 -53.55 48.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.927 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.592 ' CD2' HG12 ' A' ' 78' ' ' ILE . 86.8 mt -55.35 -39.79 70.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.921 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 14.5 t -60.75 -15.64 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.713 0.292 . . . . 0.0 110.888 179.337 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.45 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.089 0.471 . . . . 0.0 111.646 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.914 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.75 130.4 54.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.602 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.619 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.07 111.95 19.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.864 179.753 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.806 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -124.71 173.45 8.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.887 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 6.5 m -161.73 124.06 2.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.14 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -115.06 170.67 13.34 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.615 HD11 HD23 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -122.72 117.95 26.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.478 0.639 . . . . 0.0 111.687 -179.438 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.916 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.1 mt -82.24 91.17 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.638 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 177.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.916 HD11 HG23 ' A' ' 64' ' ' THR . 19.6 mt -79.57 143.23 12.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.833 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.726 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 32.7 p90 -148.5 122.26 9.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.277 -178.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 103' ' ' VAL . 63.2 mtm180 -80.79 114.2 19.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.435 ' H ' ' HG3' ' A' ' 102' ' ' GLU . 15.9 ttm180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.81 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.718 0.294 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.726 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.3 mt -102.27 151.13 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.411 0.624 . . . . 0.0 112.377 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.664 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 41.8 mt-10 -135.33 139.69 44.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.422 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.9 m-85 -101.36 152.42 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 23.6 tp -85.17 138.59 32.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.931 179.114 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.3 mt -138.37 136.22 36.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.502 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.703 HD11 ' HG3' ' A' ' 46' ' ' PRO . 13.6 mt -113.84 113.04 24.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.654 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 6.2 tp60 -66.12 126.6 29.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 110.868 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.049 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.664 ' HB3' HD22 ' A' ' 33' ' ' LEU . 77.0 m95 -112.81 120.31 41.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.532 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.581 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.9 OUTLIER -145.32 130.91 9.39 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 31.2 Cg_exo -58.49 175.95 0.48 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.075 1.85 . . . . 0.0 111.594 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.721 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.8 Cg_exo -57.78 105.02 0.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.501 2.134 . . . . 0.0 112.78 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HE3' ' HB ' ' A' ' 44' ' ' THR . 8.9 mtmp? -101.22 144.73 29.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.704 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.463 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -122.82 -162.67 11.6 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.564 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.54 96.0 3.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.94 0.4 . . . . 0.0 110.642 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.695 ' N ' HG21 ' A' ' 59' ' ' THR . 2.1 p -77.88 132.85 31.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.828 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.57 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -96.98 179.17 1.16 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.107 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.1 Cg_exo -57.01 -59.06 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.145 1.897 . . . . 0.0 112.593 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.65 2.29 87.55 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.47 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.52 ' H ' ' HG2' ' A' ' 51' ' ' GLU . 9.7 tt0 -80.21 174.01 12.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.789 0.328 . . . . 0.0 110.6 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.858 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.7 t70 -94.39 153.77 17.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.216 0.532 . . . . 0.0 110.432 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.603 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -72.14 -63.37 1.15 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.286 -179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 77' ' ' ILE . 20.7 tp -63.97 -39.54 94.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.618 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.858 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.76 -49.93 56.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.666 0.27 . . . . 0.0 110.745 -179.782 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.695 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.5 m -54.03 -40.8 67.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.505 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -73.79 -28.73 61.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 178.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.709 HD22 ' HB2' ' A' ' 72' ' ' ALA . 90.1 mt -74.94 -53.49 8.91 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.75 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -59.81 -38.22 81.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.419 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.89 -36.11 82.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.023 0.44 . . . . 0.0 109.962 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.916 HG23 HD11 ' A' ' 15' ' ' ILE . 14.0 m -60.13 -55.91 28.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.597 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.571 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -70.16 -22.11 63.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.868 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -79.06 -40.19 31.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.897 0.38 . . . . 0.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 96.1 mt-10 -109.91 11.24 24.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.44 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -155.47 -6.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.51 0.31 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.819 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.763 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.7 mt -103.06 121.14 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 117.049 0.425 . . . . 0.0 110.48 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.4 pt-20 -108.66 173.27 6.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.082 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.97 -37.58 32.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.381 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.36 -16.14 73.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.153 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.512 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 1.6 tp60 -102.49 -4.41 25.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.524 0.202 . . . . 0.0 111.261 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -134.39 -174.07 3.46 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.857 0.36 . . . . 0.0 110.219 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.556 ' H ' ' H ' ' A' ' 102' ' ' GLU . 51.4 m -130.48 100.96 5.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.29 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 57' ' ' LEU . 14.7 mm -74.1 129.34 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.397 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.514 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -92.27 139.58 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.528 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -98.74 151.41 20.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.0 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -26.42 24.15 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.453 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.611 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 11.1 t80 -104.3 127.35 51.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.017 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.465 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.4 ttpt -158.12 125.7 5.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.154 0.502 . . . . 0.0 111.662 179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 139.91 25.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.551 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.896 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.7 OUTLIER -120.96 132.84 55.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.921 0.391 . . . . 0.0 111.429 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.8 mt -98.25 116.93 31.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.615 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.5 m-80 -107.22 125.38 51.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.378 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -167.37 143.18 4.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.092 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.593 HG23 ' CA ' ' A' ' 92' ' ' LYS . 8.3 p -83.66 106.45 14.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.626 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.23 -101.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.837 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 6.0 ptt180 -57.16 -41.41 79.15 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.424 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 6.6 p-10 172.55 29.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.376 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -157.73 128.96 3.75 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.292 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.914 ' O ' HD12 ' A' ' 8' ' ' LEU . 40.8 Cg_endo -66.86 121.33 8.52 Favored 'Trans proline' 0 CA--C 1.514 -0.48 0 C-N-CA 123.287 2.658 . . . . 0.0 112.525 -179.415 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.806 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -104.92 123.65 48.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.895 -178.63 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 97.4 m -91.24 106.31 18.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.6 t -108.5 108.46 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.896 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.58 127.54 40.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.042 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.658 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.0 m-85 -115.35 130.0 56.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.603 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 15.0 m-90 -111.09 169.65 8.63 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.134 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 81' ' ' PHE . 1.1 mt -102.95 112.32 25.09 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.34 151.2 40.38 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.556 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.6 tt0 -125.88 112.24 15.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.414 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.768 HG12 HD23 ' A' ' 75' ' ' LEU . 5.0 m -72.07 112.92 8.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.548 0.69 . . . . 0.0 110.79 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 2.0 ptpt -58.01 -27.16 63.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.225 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.899 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 16.2 m-20 -94.32 111.06 22.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.203 0.525 . . . . 0.0 111.593 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.454 ' CE1' ' NH1' ' A' ' 17' ' ' ARG . 17.0 t80 -57.67 -39.99 78.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.422 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -103.86 27.34 7.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.715 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.899 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -46.9 151.53 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.749 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.535 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.2 OUTLIER -76.8 144.75 38.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.294 0.568 . . . . 0.0 111.231 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.875 HG21 ' CD1' ' A' ' 119' ' ' TYR . 44.9 mm -121.63 99.3 6.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.967 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.68 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -98.77 101.83 13.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.926 -178.669 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.591 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.4 mt -95.94 140.41 30.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.73 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.7 p -83.08 -164.94 0.95 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.414 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -72.86 -4.53 32.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.501 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -91.47 -22.89 20.18 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.603 0.239 . . . . 0.0 111.426 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 94.2 m-70 -120.84 129.36 53.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.017 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -98.74 -12.53 20.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.573 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.39 173.73 6.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.418 . . . . 0.0 111.436 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.875 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.8 p90 -146.68 174.64 11.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.578 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 49.7 mtt180 -156.12 153.6 29.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 111.745 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 95.2 m95 -119.02 107.67 13.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.276 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.2 167.42 21.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 111.51 -178.654 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.67 -152.6 3.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.1 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' CD ' ' A' ' 141' ' ' GLN . 8.4 tp -77.25 -43.42 33.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.684 0.278 . . . . 0.0 111.292 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.2 pt-20 -59.91 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.665 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.892 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.28 -43.76 60.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.055 -179.434 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.45 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -59.36 -29.82 67.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.361 0.601 . . . . 0.0 109.747 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.7 m -84.84 -33.71 22.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.49 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.892 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.67 -43.51 84.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.559 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.586 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -75.27 -45.73 38.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 127' ' ' ALA . . . -80.43 54.44 2.04 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.105 0.479 . . . . 0.0 109.865 178.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.0 -33.59 0.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.566 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.534 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 4.4 m-85 -54.2 119.52 5.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.108 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -45.98 -47.72 16.61 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.302 0.572 . . . . 0.0 111.354 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.922 ' HB3' HD13 ' A' ' 85' ' ' LEU . 26.0 mp0 -49.66 -57.14 7.77 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.911 -179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.451 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.14 -46.86 87.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.398 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.02 -41.36 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.169 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.97 -47.38 65.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.411 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.916 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.15 -41.98 63.01 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.38 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.45 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.4 OUTLIER -81.65 -28.19 33.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.119 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.532 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.63 -52.56 43.76 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.22 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.611 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -74.47 -25.37 59.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 -179.769 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.531 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.53 -47.64 88.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.472 -0.871 . . . . 0.0 111.771 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.684 ' NE2' HD12 ' A' ' 29' ' ' ILE . 5.9 t-160 -76.08 -29.67 58.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.962 0.41 . . . . 0.0 110.655 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -68.95 -52.81 25.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -61.52 -47.57 85.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.856 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.59 ' HG ' HD13 ' A' ' 100' ' ' LEU . 65.0 mt -54.29 -44.48 71.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.593 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.6 -11.99 59.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.926 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.439 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.625 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.222 0 CA-C-O 121.251 0.548 . . . . 0.0 111.362 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.947 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -111.09 138.66 47.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.01 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.766 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -84.25 112.84 20.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.578 179.432 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 95' ' ' THR . . . -124.71 170.73 10.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.258 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -163.16 124.48 2.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.087 0.47 . . . . 0.0 111.115 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.639 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -118.52 177.61 16.5 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.583 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -131.2 118.12 19.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.028 0.414 . . . . 0.0 111.762 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.783 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.4 mt -82.73 92.08 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 32.7 mt -83.73 145.16 8.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.444 -177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.744 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.2 122.47 7.21 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.284 -179.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.65 112.94 18.49 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.124 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.436 -179.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.781 0.324 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.744 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -115.12 146.44 19.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.239 0.542 . . . . 0.0 112.149 -179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.605 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 20.5 mt-10 -136.35 129.68 31.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.926 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.642 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 63.7 m-85 -91.64 150.01 21.36 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.62 HD23 HD12 ' A' ' 15' ' ' ILE . 55.1 tp -84.82 133.73 34.32 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -134.98 141.18 46.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.639 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.603 HD11 ' HG3' ' A' ' 46' ' ' PRO . 14.4 mt -119.09 121.47 39.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.184 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.608 ' NE2' ' CZ2' ' A' ' 43' ' ' TRP . 11.7 tt0 -61.42 162.48 7.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.59 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.795 -179.949 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.914 0.387 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.707 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 40.8 m95 -101.66 119.79 39.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -139.59 141.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.797 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.94 166.48 2.99 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.516 2.144 . . . . 0.0 112.09 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 24.3 Cg_exo -63.33 82.67 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.751 2.301 . . . . 0.0 112.132 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.458 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 12.8 pttm -87.05 156.22 19.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.085 0.469 . . . . 0.0 111.335 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.23 -178.86 19.42 Favored Glycine 0 N--CA 1.45 -0.371 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.302 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.478 ' NE2' ' HB3' ' A' ' 8' ' ' LEU . 4.8 t-80 -108.49 118.69 37.43 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.766 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -93.06 134.79 29.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.256 0.55 . . . . 0.0 111.25 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.696 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 5.1 tt0 -93.52 152.06 40.63 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.878 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.5 Cg_endo -54.23 -22.04 24.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.644 2.23 . . . . 0.0 112.58 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.696 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.07 -14.35 36.56 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.795 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -83.06 168.15 17.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.66 0.267 . . . . 0.0 110.671 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 1.047 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 27.4 t70 -85.69 161.65 19.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.114 0.483 . . . . 0.0 110.747 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.52 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -72.05 -63.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 -179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.601 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 22.7 tp -66.66 -39.4 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.962 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 1.047 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.3 tt0 -49.69 -46.76 50.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.452 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 96.9 m -58.85 -47.59 84.33 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -65.75 -29.81 70.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.085 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.834 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.8 mt -72.18 -53.53 12.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.948 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -64.02 -33.05 74.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.567 -179.85 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.95 -32.15 72.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.028 0.442 . . . . 0.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 23.1 m -60.46 -51.17 70.61 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.499 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.531 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -75.54 -20.6 58.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.07 179.673 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.3 tm-20 -78.32 -38.28 42.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.056 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.608 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 96.3 mt-10 -110.25 -0.66 17.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.8 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -141.37 -10.9 0.94 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.647 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 75.26 -4.51 40.3 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.111 -1.042 . . . . 0.0 113.088 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.851 HD11 ' CD1' ' A' ' 110' ' ' ILE . 4.5 mt -100.71 126.95 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.085 0.469 . . . . 0.0 111.278 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.0 pt-20 -109.96 170.44 8.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.786 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.98 -38.89 11.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.039 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.95 -22.77 70.69 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.247 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.594 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -98.67 -1.9 39.63 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.476 0.179 . . . . 0.0 111.244 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -136.95 -169.63 2.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.201 178.148 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.589 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 24.4 m -136.34 99.68 4.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.609 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.597 HG21 HD21 ' A' ' 57' ' ' LEU . 8.4 mm -72.01 123.57 26.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.968 0.413 . . . . 0.0 111.009 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.515 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.87 139.23 17.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.777 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -98.75 151.7 20.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.097 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.1 -23.75 33.48 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.06 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.575 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 7.4 t80 -108.88 127.24 53.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -159.01 127.79 5.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.214 0.53 . . . . 0.0 111.645 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.469 HH12 ' HG2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -153.81 141.52 20.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.851 179.099 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.862 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.86 132.53 54.62 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.178 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 135' ' ' GLU . 10.7 mt -94.54 118.74 32.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.351 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.72 126.02 51.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -166.57 141.09 4.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.021 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.599 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.2 p -80.72 113.33 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.878 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.19 -107.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.369 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -61.65 -42.35 98.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.964 0.411 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -176.69 26.83 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.808 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.48 128.18 4.15 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.761 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.6 Cg_endo -72.22 116.0 4.54 Favored 'Trans proline' 0 CA--C 1.506 -0.895 0 C-N-CA 123.173 2.582 . . . . 0.0 112.404 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.668 ' HD3' ' CG2' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -105.93 122.2 45.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.791 -179.205 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.583 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 22.9 m -79.47 120.27 23.64 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.708 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 9.5 t -115.0 108.72 26.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.815 -178.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.862 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.42 133.59 29.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.716 ' HB3' HG13 ' A' ' 14' ' ' ILE . 77.6 m-85 -118.11 129.85 55.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.107 0.48 . . . . 0.0 111.743 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 10.6 m-90 -117.47 139.57 50.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.934 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.496 HD12 HG21 ' A' ' 78' ' ' ILE . 1.1 mt -76.58 116.17 17.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -126.94 146.37 50.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 110.681 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.57 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.1 tm-20 -122.77 116.93 24.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.551 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 12.9 m -73.12 120.65 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.371 0.605 . . . . 0.0 110.422 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -28.96 69.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.121 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.783 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 51.4 t0 -98.72 128.21 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.064 0.459 . . . . 0.0 111.978 -179.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.56 -42.24 61.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.436 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -91.25 19.7 5.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.483 178.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.783 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.4 p -47.69 143.58 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.927 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -66.35 142.55 57.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.468 0.652 . . . . 0.0 111.649 -178.994 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.851 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.96 95.36 3.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.953 179.129 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.647 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.3 mtp180 -95.22 101.34 13.07 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.727 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.75 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 12.2 mt -95.42 151.88 18.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.86 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.3 m -81.38 -169.03 2.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.109 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.25 6.12 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.535 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -102.23 -32.11 10.23 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.612 0.244 . . . . 0.0 111.149 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.75 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 51.9 m-70 -97.16 113.47 25.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.974 0.416 . . . . 0.0 111.078 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -76.19 -19.46 58.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.699 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.77 -177.12 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.0 111.94 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.709 ' CG ' HG21 ' A' ' 110' ' ' ILE . 36.3 p90 -151.01 162.73 40.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.992 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.707 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -150.67 141.64 22.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.266 0.555 . . . . 0.0 111.681 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -98.79 107.64 20.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.222 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.09 168.31 19.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.814 -177.88 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.5 -152.02 4.17 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.599 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.469 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.7 tp -77.0 -40.94 44.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.826 0.346 . . . . 0.0 111.044 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 15.6 pt-20 -61.0 -51.18 70.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.866 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.719 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -72.69 -32.97 66.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 0.0 110.703 -179.334 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.533 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -69.91 -29.69 66.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.357 0.599 . . . . 0.0 109.497 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.43 -31.36 24.66 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.429 178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.7 OUTLIER -66.64 -45.51 78.78 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.782 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.8 mt -74.09 -44.82 52.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.67 51.98 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.191 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.488 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.1 -28.35 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.67 -179.494 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -58.11 117.41 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.405 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.523 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 1.2 tttm -46.06 -44.98 15.85 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 111.778 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.763 ' HB3' HD13 ' A' ' 85' ' ' LEU . 20.9 mp0 -53.47 -53.36 52.51 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.624 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.498 ' CE ' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.97 -49.64 75.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.746 0.308 . . . . 0.0 111.394 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.523 ' HZ2' ' HA ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -48.65 -39.61 24.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.11 179.656 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.88 -46.45 57.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.069 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.783 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.7 -41.47 66.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.161 0.505 . . . . 0.0 109.972 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.47 -27.93 41.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.174 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.01 -52.6 40.51 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.568 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.575 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 2.4 mp0 -73.75 -25.48 60.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.572 -179.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.459 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -62.09 -43.12 99.59 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.378 -0.915 . . . . 0.0 111.108 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.462 ' NE2' HD12 ' A' ' 29' ' ' ILE . 4.8 t-80 -79.75 -31.92 41.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.027 0.442 . . . . 0.0 109.995 178.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLN . . . . . 0.405 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 13.6 tp60 -65.53 -50.88 63.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.743 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -63.16 -50.51 70.11 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.732 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.515 ' CD2' HG12 ' A' ' 78' ' ' ILE . 97.8 mt -55.67 -30.6 61.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.98 -18.83 60.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.691 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.422 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.141 0 CA-C-O 121.265 0.555 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.895 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -117.92 140.31 49.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.809 178.839 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.702 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -84.56 133.11 34.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.748 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.453 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -150.66 166.34 30.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.596 179.281 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 96.4 m -155.25 124.59 6.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.916 0.388 . . . . 0.0 111.515 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.627 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -112.06 172.59 14.89 Favored Glycine 0 N--CA 1.452 -0.292 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 178.736 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.61 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -127.14 117.76 23.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.294 0.547 . . . . 0.0 111.487 -179.931 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.94 HD11 ' HB1' ' A' ' 139' ' ' ALA . 74.3 mt -84.03 91.53 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.038 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 10.3 mt -83.11 146.2 7.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.172 -178.501 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.753 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.6 p90 -151.82 122.95 7.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.961 -178.755 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.771 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.83 111.64 17.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.949 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.257 0 CA-C-O 120.716 0.293 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.753 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 11.2 mt -99.58 147.83 6.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.376 0.607 . . . . 0.0 111.866 -179.17 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.7 mt-10 -136.74 122.94 20.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.306 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.6 m-85 -87.39 141.91 28.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.934 -178.877 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.56 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 38.3 tp -79.97 133.61 36.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -136.65 137.0 39.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.538 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.562 HD22 HD22 ' A' ' 112' ' ' LEU . 12.6 mt -113.8 125.9 54.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.985 -179.533 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.561 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 2.1 tt0 -57.82 168.61 0.88 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.394 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.126 -179.985 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.577 ' O ' HG23 ' A' ' 44' ' ' THR . 50.6 m95 -111.7 135.6 52.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.021 -179.915 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 ' O ' ' A' ' 43' ' ' TRP . 6.6 p -160.95 147.72 11.79 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.671 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.439 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 23.8 Cg_endo -61.36 169.44 6.51 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.574 2.183 . . . . 0.0 112.202 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 63.6 Cg_endo -75.54 108.59 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.798 2.332 . . . . 0.0 112.388 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.0 pttp -106.36 141.15 38.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 111.295 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 63' ' ' ALA . . . -110.83 -161.74 17.77 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.964 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -130.04 105.12 7.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.801 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.702 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -78.22 113.93 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 121.295 0.569 . . . . 0.0 110.976 -179.783 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.653 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -74.52 177.99 1.93 Allowed Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.578 -179.919 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.653 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.3 Cg_exo -56.84 -50.04 12.76 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.338 2.026 . . . . 0.0 112.771 -179.518 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -96.06 12.88 66.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.908 -179.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -86.5 167.29 14.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.994 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.3 t70 -92.21 158.71 16.0 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.18 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.47 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 2.9 m-20 -73.08 -61.46 1.81 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.304 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.679 HD13 ' CD2' ' A' ' 99' ' ' TRP . 17.9 tp -63.2 -39.78 95.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 0.0 110.935 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.84 -50.78 44.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 110.862 -179.897 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.58 HG21 ' N ' ' A' ' 50' ' ' VAL . 56.3 m -55.63 -41.49 73.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.59 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.25 -30.32 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.996 178.357 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.75 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.9 mt -72.76 -52.25 15.81 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.272 179.133 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.47 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.58 -40.65 95.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.811 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.456 ' HB2' ' CA ' ' A' ' 48' ' ' GLY . . . -60.31 -36.5 78.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.984 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -59.78 -58.07 10.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.855 179.299 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.556 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.7 pt20 -68.91 -21.8 64.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.47 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 22.5 mt-10 -79.03 -42.87 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.358 . . . . 0.0 110.958 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.58 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.8 mp0 -103.79 1.78 32.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.742 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.54 -5.87 0.73 Allowed 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -179.804 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.7 -1.59 9.61 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.141 -1.028 . . . . 0.0 112.811 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.736 ' O ' HG22 ' A' ' 64' ' ' THR . 1.6 mt -103.06 125.07 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.308 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -111.38 173.55 6.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.741 -179.619 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.42 -38.27 28.54 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.629 179.402 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.71 -14.46 60.57 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.449 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -106.98 -15.44 14.7 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.821 0.311 . . . . 0.0 111.453 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.833 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -123.65 -175.13 3.14 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.939 0.399 . . . . 0.0 110.449 178.623 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.546 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 43.0 m -129.27 100.76 5.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.094 -179.58 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.672 HG21 HD21 ' A' ' 57' ' ' LEU . 13.2 mm -72.82 115.09 13.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.762 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.474 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -75.91 136.01 25.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -93.76 151.61 19.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.338 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.24 -23.51 35.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.292 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.757 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.7 t80 -107.29 127.03 53.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.789 0.328 . . . . 0.0 111.174 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.6 ttpt -158.72 125.12 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 179.637 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.92 145.05 31.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.085 179.403 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.83 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.9 OUTLIER -126.17 126.38 44.01 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.224 179.852 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.7 mt -90.68 120.06 31.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.4 m120 -110.47 124.22 51.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 -179.499 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -166.87 137.85 3.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.966 0.412 . . . . 0.0 111.126 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.569 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -76.33 113.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.345 0.593 . . . . 0.0 110.889 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.82 -105.56 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.819 -178.72 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 1.6 ptt-85 -63.45 -35.92 82.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.978 0.418 . . . . 0.0 110.394 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 90' ' ' ARG . 9.6 t-20 176.28 27.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.969 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.794 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.27 128.04 3.87 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 0.0 110.981 -179.968 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.895 ' O ' HD12 ' A' ' 8' ' ' LEU . 44.0 Cg_endo -70.18 118.69 5.83 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.422 2.748 . . . . 0.0 113.099 -179.226 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.862 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.2 mmmt -99.26 130.2 45.54 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.144 -179.374 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.8 m -95.6 107.16 19.33 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.585 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.748 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 44.8 t -107.13 108.0 24.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.789 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.83 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.13 128.71 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.519 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.577 ' HB3' HG13 ' A' ' 14' ' ' ILE . 10.6 m-85 -108.54 163.25 13.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.334 0.588 . . . . 0.0 111.439 -178.83 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.679 ' CD2' HD13 ' A' ' 57' ' ' LEU . 2.8 m-90 -150.75 136.23 17.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.172 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.757 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -76.97 114.6 15.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.11 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -125.86 151.46 46.82 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 120.749 0.309 . . . . 0.0 111.305 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.527 ' H ' ' H ' ' A' ' 76' ' ' THR . 0.3 OUTLIER -124.86 113.35 17.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.163 -179.598 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.833 HG12 HD23 ' A' ' 75' ' ' LEU . 10.5 m -71.92 122.83 25.06 Favored 'Isoleucine or valine' 0 C--N 1.338 0.07 0 CA-C-O 121.171 0.51 . . . . 0.0 110.323 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 2.1 mttt -65.26 -21.55 66.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.98 -178.12 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.815 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 5.9 m-20 -102.67 113.15 26.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.221 0.534 . . . . 0.0 111.624 -179.048 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.424 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 13.4 t80 -58.56 -38.33 77.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.237 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -103.24 23.3 12.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.548 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.815 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.1 p -42.99 148.83 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.826 -179.529 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.694 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 15.5 pm0 -73.22 141.76 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.273 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.711 ' CD1' HD11 ' A' ' 70' ' ' ILE . 36.6 mm -120.43 105.19 16.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.634 179.086 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.694 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -103.38 97.44 7.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.59 -179.241 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.659 HD11 ' HD1' ' A' ' 119' ' ' TYR . 3.3 mt -95.75 144.46 26.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.357 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 115' ' ' GLU . 2.7 p -94.06 -169.36 2.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.606 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.5 p-80 -67.55 10.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.4 mt-10 -100.88 -30.48 11.65 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.72 0.295 . . . . 0.0 110.887 179.431 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.406 ' ND1' ' HB2' ' A' ' 34' ' ' LEU . 26.1 m-70 -124.78 124.0 41.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.889 0.376 . . . . 0.0 110.942 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -17.57 44.77 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.5 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -163.46 -176.56 4.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.241 0.544 . . . . 0.0 111.507 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.678 ' CE2' HG13 ' A' ' 110' ' ' ILE . 31.9 p90 -153.59 172.38 17.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.325 -179.589 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -157.9 157.87 33.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.118 0.485 . . . . 0.0 111.03 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.56 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 83.5 m95 -122.31 107.06 11.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.382 178.823 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.82 165.09 26.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 0.0 111.567 -178.402 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.53 -154.14 1.21 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.819 179.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.8 tp -76.73 -43.67 36.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.836 0.35 . . . . 0.0 110.745 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -57.36 -51.63 68.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.614 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.668 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.62 -53.08 20.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.811 0.338 . . . . 0.0 110.244 -179.887 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.459 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.04 -27.41 7.93 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.525 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.442 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.5 OUTLIER -82.69 -35.25 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.511 178.392 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -63.55 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.5 -179.642 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.606 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -77.91 -39.77 41.87 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.265 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -80.03 47.8 0.92 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 179.285 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.19 -29.34 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.726 -179.861 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.458 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -59.69 119.83 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.421 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -46.46 -46.24 18.77 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.218 0.532 . . . . 0.0 111.847 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 1.009 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.1 mp0 -52.7 -56.39 15.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.893 -178.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.496 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -59.43 -41.0 88.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.571 0.224 . . . . 0.0 111.446 -179.347 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.59 -42.3 64.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.103 179.455 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.575 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.11 -47.62 67.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.608 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.34 -49.1 62.07 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.92 0.391 . . . . 0.0 110.206 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -74.36 -26.81 60.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.319 178.887 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.3 OUTLIER -68.06 -52.72 32.07 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.095 -179.818 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 3.1 mm-40 -68.79 -29.17 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.264 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.438 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.71 -48.46 84.83 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.854 179.379 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.457 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -74.55 -28.95 61.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.887 0.375 . . . . 0.0 110.743 179.579 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 145' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 8.1 tp60 -68.35 -51.46 44.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.481 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -65.43 -51.21 61.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.996 0.427 . . . . 0.0 110.953 -179.714 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.474 ' CD2' HG12 ' A' ' 78' ' ' ILE . 93.9 mt -56.33 -32.29 64.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.899 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 4.2 t -75.98 -14.03 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.0 110.714 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.784 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.646 ' HB1' ' O ' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 121.204 0.526 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.18 131.26 56.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.354 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.548 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -82.89 132.39 35.16 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.673 -178.907 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.681 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -145.1 163.22 34.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.507 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 56.7 m -154.52 124.31 6.65 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.029 0.443 . . . . 0.0 111.732 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.26 171.49 13.87 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.534 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -122.57 117.89 26.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.28 0.54 . . . . 0.0 112.44 -179.174 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.826 HD11 ' HB1' ' A' ' 139' ' ' ALA . 54.2 mt -80.73 92.12 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.781 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.287 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.867 HD11 HG23 ' A' ' 64' ' ' THR . 27.2 mt -84.4 146.88 6.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.706 -178.035 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.78 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.6 p90 -153.88 121.15 5.76 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.288 -179.385 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' CG ' ' HB2' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -79.74 114.42 18.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.518 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.465 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.127 -179.112 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.78 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.7 mt -111.14 141.11 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.056 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.673 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.1 mt-10 -133.89 127.25 32.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.046 179.102 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.678 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -87.09 154.37 20.8 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.5 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 15' ' ' ILE . 39.2 tp -90.73 135.01 33.99 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.843 178.992 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 127' ' ' ALA . 5.9 mt -135.11 142.02 46.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.757 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 112' ' ' LEU . 14.5 mt -121.81 107.42 12.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HB2' ' CD2' ' A' ' 43' ' ' TRP . 37.3 tt0 -67.71 141.77 56.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.191 179.964 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 120.849 0.357 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.697 ' O ' HG23 ' A' ' 44' ' ' THR . 37.5 m95 -98.11 150.1 21.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.035 179.916 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.77 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -171.54 144.02 1.56 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.524 -179.728 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.484 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 32.8 Cg_exo -61.56 165.63 13.1 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.356 2.037 . . . . 0.0 112.171 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.12 102.07 0.2 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.484 2.123 . . . . 0.0 112.443 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -87.92 155.44 19.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.907 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.511 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -138.13 174.29 22.0 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.206 179.828 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -115.81 103.53 10.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.677 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.666 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -81.3 127.37 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.302 0.572 . . . . 0.0 111.363 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.0 tt0 -88.46 153.24 50.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.291 179.968 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 12.5 Cg_endo -55.57 -18.74 21.07 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.985 2.456 . . . . 0.0 112.585 -179.525 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.632 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -107.54 -6.67 32.99 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.926 179.213 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -88.75 176.48 7.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.925 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -92.7 161.41 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.029 0.442 . . . . 0.0 109.991 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 24.3 m-20 -73.7 -61.06 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.849 -179.099 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.652 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 36.6 tp -65.91 -40.01 91.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.74 0.305 . . . . 0.0 110.831 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.925 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.15 -47.15 54.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.79 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.666 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.1 m -58.0 -43.6 86.72 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -69.94 -32.7 71.11 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.019 178.755 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.2 mt -71.11 -51.77 23.18 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.491 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.2 OUTLIER -61.78 -41.03 97.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.011 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.22 -34.78 77.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.163 0.506 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.867 HG23 HD11 ' A' ' 15' ' ' ILE . 93.5 m -60.08 -51.39 69.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.434 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.535 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.0 pt20 -76.85 -21.81 54.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.515 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -78.27 -35.03 48.59 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.304 . . . . 0.0 110.73 179.193 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 2.0 mp0 -108.18 -14.24 14.75 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.5 -8.79 4.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.691 0.281 . . . . 0.0 111.632 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.973 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.54 -8.65 25.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.236 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.795 HG23 ' HG2' ' A' ' 74' ' ' GLN . 3.2 mt -94.22 123.4 46.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.012 -179.677 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pm0 -103.54 169.38 8.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.023 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.929 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -45.89 -39.13 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.364 179.719 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.95 -23.02 74.32 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.382 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.795 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -95.76 1.39 53.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.726 0.298 . . . . 0.0 111.324 -179.994 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -137.69 -166.41 1.95 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.692 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -140.57 98.52 3.43 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.57 HG13 HD21 ' A' ' 61' ' ' LEU . 9.4 mm -73.24 114.2 12.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.074 0.464 . . . . 0.0 111.778 -179.848 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.667 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -77.05 138.13 21.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.62 179.322 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -97.52 148.82 22.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.403 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.93 -24.64 27.7 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.12 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.674 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 12.1 t80 -104.35 127.43 52.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.836 0.35 . . . . 0.0 111.146 -179.842 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.521 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -158.94 128.19 5.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.261 0.553 . . . . 0.0 111.31 179.577 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.4 tpt85 -154.53 137.86 15.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.95 179.294 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.844 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -120.83 136.13 54.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.169 0.509 . . . . 0.0 111.455 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.96 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.6 mt -95.24 118.21 31.61 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.168 179.163 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -108.34 126.3 52.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.735 -179.261 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.4 p90 -167.0 141.0 3.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 -179.633 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.661 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.9 p -80.7 113.57 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.53 0.681 . . . . 0.0 110.64 179.294 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.61 -102.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.352 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.432 HH11 ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -77.48 -35.01 54.14 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 120.964 0.412 . . . . 0.0 110.312 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -172.89 16.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.603 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.819 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -148.6 126.38 5.76 Favored Pre-proline 0 N--CA 1.451 -0.384 0 CA-C-O 120.945 0.402 . . . . 0.0 111.365 -179.616 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.836 ' O ' HD12 ' A' ' 8' ' ' LEU . 50.6 Cg_endo -69.06 118.71 5.84 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.615 2.877 . . . . 0.0 113.234 -179.52 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 4.6 mmmt -101.39 124.76 47.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.331 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -89.4 114.93 26.45 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.567 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.719 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 37.5 t -113.52 108.03 24.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.759 -178.808 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.844 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.35 132.5 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.997 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.695 ' HB3' HG13 ' A' ' 14' ' ' ILE . 43.0 m-85 -118.66 129.97 55.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.126 0.488 . . . . 0.0 111.656 -178.91 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.652 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 1.1 m-90 -118.47 142.62 47.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.387 179.47 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 HG21 ' A' ' 78' ' ' ILE . 1.5 mt -76.07 123.09 25.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -133.85 134.39 42.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.441 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.63 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.4 tt0 -114.78 115.15 26.56 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.182 -179.533 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.804 HG12 HD23 ' A' ' 75' ' ' LEU . 16.6 m -72.05 108.29 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-O 121.547 0.689 . . . . 0.0 110.143 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -57.07 -13.04 2.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.974 -178.774 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.2 t0 -107.87 116.6 32.24 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.012 0.434 . . . . 0.0 111.347 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -65.59 -38.96 90.99 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.323 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.39 25.74 6.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.511 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.1 p -51.37 146.33 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.87 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.1 pm0 -74.12 145.84 44.01 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.065 -179.357 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.794 HD13 HD11 ' A' ' 70' ' ' ILE . 32.7 mm -122.47 101.22 9.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.951 179.389 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.973 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -102.11 97.03 7.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.095 -179.468 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 34' ' ' LEU . 6.1 mt -90.03 150.53 22.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.801 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.2 t -83.86 -168.13 2.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.09 1.58 10.79 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.552 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -98.83 -29.14 13.14 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.591 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.6 m80 -109.11 110.81 22.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.769 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -89.53 -6.73 56.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.842 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -170.61 152.62 3.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.107 0.48 . . . . 0.0 111.838 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.725 ' CE2' HG13 ' A' ' 110' ' ' ILE . 32.7 p90 -133.23 175.81 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.306 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.607 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -157.54 166.32 33.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.368 0.604 . . . . 0.0 111.798 179.801 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.407 ' CE3' ' HG2' ' A' ' 17' ' ' ARG . 83.5 m95 -131.01 106.75 8.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.335 178.751 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.761 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -137.38 170.17 16.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.205 0.526 . . . . 0.0 111.518 -178.441 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.71 -153.26 3.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.706 179.437 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.5 tp -77.23 -41.26 41.9 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.989 0.423 . . . . 0.0 111.264 179.724 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.6 pt-20 -61.25 -50.93 71.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.488 -179.566 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.761 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -71.65 -40.57 69.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.403 -179.347 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.648 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -62.25 -32.42 73.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.8 m -82.19 -31.13 30.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.569 179.162 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 1.2 pp0? -67.23 -44.75 78.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.011 -179.64 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.624 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.8 mt -74.71 -46.19 39.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.923 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.429 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -77.66 51.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.296 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.476 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.18 -26.99 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.88 -179.326 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.653 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.2 m-85 -61.03 119.43 8.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.413 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.448 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 0.1 OUTLIER -44.89 -46.75 11.06 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.078 0.466 . . . . 0.0 111.87 -179.02 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.96 ' HB3' HD13 ' A' ' 85' ' ' LEU . 13.1 mp0 -52.46 -54.49 31.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.827 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.77 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.61 -41.37 98.94 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -178.595 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -55.77 -34.49 65.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.685 0.278 . . . . 0.0 110.344 179.729 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.79 -43.75 53.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.471 179.544 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.826 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.41 -45.54 80.62 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.302 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.648 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.5 OUTLIER -75.58 -26.41 57.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.991 178.138 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.514 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.1 OUTLIER -68.4 -52.06 37.15 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.31 0.576 . . . . 0.0 110.533 179.867 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.674 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 4.5 mm-40 -69.9 -28.99 66.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.861 -179.594 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -58.29 -47.98 86.33 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.313 179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.491 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.9 OUTLIER -75.21 -33.08 61.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.984 0.421 . . . . 0.0 110.342 179.587 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 145' ' ' GLN . . . . . 0.423 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 4.4 tp60 -63.31 -51.88 64.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.716 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -61.93 -50.48 71.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.739 179.815 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.481 ' HG ' HD13 ' A' ' 100' ' ' LEU . 69.9 mt -59.48 -34.11 72.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.1 t -74.02 -20.02 60.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.724 179.36 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.53 0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.937 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.668 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 121.381 0.61 . . . . 0.0 111.49 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.075 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.39 138.87 45.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.52 179.801 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.8 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.1 OUTLIER -79.11 128.52 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.984 -179.981 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.82 161.07 39.6 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 20.8 m -157.14 123.47 4.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.162 0.506 . . . . 0.0 111.212 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.534 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.49 170.85 13.66 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.483 178.79 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.467 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -122.73 118.15 27.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.049 0.425 . . . . 0.0 111.669 -179.42 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.778 HD11 ' HB1' ' A' ' 139' ' ' ALA . 56.1 mt -83.01 91.22 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.432 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.128 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.004 HD11 HG23 ' A' ' 64' ' ' THR . 29.6 mt -81.15 145.29 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.049 -178.895 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.713 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 46.2 p90 -151.91 121.19 6.77 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.016 -178.866 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.469 ' CD ' ' HA ' ' A' ' 106' ' ' TYR . 8.9 ttp180 -76.67 118.02 18.88 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.3 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.617 HH11 ' HB2' ' A' ' 18' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.946 -178.378 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.713 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.3 mt -107.61 154.9 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.114 0.483 . . . . 0.0 111.772 -179.626 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.612 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.5 mp0 -138.37 127.32 23.94 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.121 179.659 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.649 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 55.2 m-85 -91.35 146.68 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.955 0.407 . . . . 0.0 112.036 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.646 HD23 HD12 ' A' ' 15' ' ' ILE . 43.5 tp -81.88 132.68 35.28 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.652 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.499 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.5 mt -133.14 142.74 48.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.968 0.413 . . . . 0.0 110.791 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 112' ' ' LEU . 17.2 mt -121.81 104.2 9.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.535 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.1 tt0 -64.56 134.07 53.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.271 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.366 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.599 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 42' ' ' HIS . . . . . 0.441 ' HB2' ' HE1' ' A' ' 133' ' ' PHE . 3.8 p-80 . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.595 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.6 m95 -104.59 137.9 41.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.296 -179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.7 OUTLIER -160.5 136.68 6.23 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.985 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.02 178.78 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.405 2.07 . . . . 0.0 111.656 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HG3' HD11 ' A' ' 34' ' ' LEU . 50.9 Cg_exo -56.31 98.12 0.07 OUTLIER 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.437 2.091 . . . . 0.0 112.644 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -97.97 129.31 44.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.773 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -146.47 140.74 8.97 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.701 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 14.2 p-80 -76.29 127.23 32.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.663 0.268 . . . . 0.0 110.798 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.8 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -88.72 137.32 21.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.984 0.421 . . . . 0.0 110.582 179.634 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.666 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 3.0 tt0 -89.72 152.12 46.48 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.4 Cg_endo -55.25 -22.91 34.7 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.524 2.149 . . . . 0.0 112.971 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.666 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.42 -11.83 43.57 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.383 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -88.05 158.64 18.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.603 0.24 . . . . 0.0 110.63 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.915 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 16.8 t0 -77.73 163.42 26.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.995 0.426 . . . . 0.0 110.22 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.87 -61.37 1.79 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.649 HD21 HG21 ' A' ' 77' ' ' ILE . 22.0 tp -64.32 -41.7 96.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.145 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.915 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 2.1 mt-10 -51.19 -45.15 61.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.687 -179.545 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.584 HG21 ' HB ' ' A' ' 50' ' ' VAL . 82.4 m -58.21 -40.91 82.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.149 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -72.49 -30.62 64.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.905 178.673 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.0 mt -72.62 -52.47 15.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.421 179.349 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.48 -41.02 96.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.804 -179.659 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 46' ' ' PRO . . . -60.45 -33.64 72.86 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.147 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 64' ' ' THR . . . . . 1.004 HG23 HD11 ' A' ' 15' ' ' ILE . 24.5 m -60.14 -58.26 9.28 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.412 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.484 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -70.18 -20.31 63.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.621 179.47 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.4 tm-20 -79.06 -39.86 32.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.125 179.666 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.414 ' O ' ' CD2' ' A' ' 112' ' ' LEU . 10.3 mm-40 -106.38 -5.3 19.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.934 -179.309 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.46 -11.76 1.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.525 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.687 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.38 -3.85 51.9 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.857 -1.164 . . . . 0.0 112.85 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.789 HD11 ' CD1' ' A' ' 110' ' ' ILE . 5.0 mt -99.01 121.79 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.53 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 pm0 -105.11 171.06 7.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.523 0.202 . . . . 0.0 111.208 -179.387 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.93 -31.7 7.78 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.698 179.921 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.89 -23.85 75.46 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.317 -0.944 . . . . 0.0 111.857 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.548 ' HB3' HG23 ' A' ' 70' ' ' ILE . 2.5 tp60 -95.03 3.85 54.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 0.0 110.921 179.655 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.897 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.48 -169.25 2.83 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.289 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -137.23 100.3 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.364 -179.671 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.649 HG21 HD21 ' A' ' 57' ' ' LEU . 10.1 mm -71.59 126.92 32.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.96 179.74 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.535 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -90.02 137.69 20.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.062 0.458 . . . . 0.0 111.07 -179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -97.85 149.95 21.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.397 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.21 -27.1 21.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.352 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.896 ' CD1' HD21 ' A' ' 100' ' ' LEU . 15.0 t80 -105.03 126.02 51.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.733 0.301 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.57 124.56 5.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.257 0.551 . . . . 0.0 111.524 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.76 140.71 21.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.464 179.053 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.959 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.0 pm0 -121.19 138.26 54.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.05 0.452 . . . . 0.0 111.771 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.797 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -98.87 116.91 32.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.622 179.457 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 0.3 OUTLIER -113.86 125.66 54.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.5 -179.995 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 10.1 p90 -166.67 146.25 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.572 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.9 p -82.37 110.71 17.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.332 179.561 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.78 -95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.627 -179.066 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.472 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -67.28 -41.17 85.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.872 0.368 . . . . 0.0 110.655 -179.923 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.499 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER 178.12 26.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.278 179.766 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.81 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.48 129.94 4.24 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.447 179.591 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.911 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.5 Cg_endo -70.07 119.58 6.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.208 2.605 . . . . 0.0 112.998 -179.195 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 1.075 ' HG2' HD13 ' A' ' 8' ' ' LEU . 7.4 mmmt -104.3 121.9 44.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.047 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.457 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.0 m -87.94 116.81 26.37 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.619 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.1 t -115.81 108.9 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.859 -178.114 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.959 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.6 mm -86.0 126.63 40.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.374 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.636 ' HB3' HG13 ' A' ' 14' ' ' ILE . 13.8 m-85 -113.27 133.25 55.2 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.085 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.636 ' CD2' HD13 ' A' ' 57' ' ' LEU . 9.3 m-90 -117.83 141.43 48.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.949 178.566 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.896 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -78.07 115.65 17.96 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.791 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.601 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -124.55 144.4 50.15 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.16 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.458 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.3 tt0 -123.1 116.38 23.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.81 0.338 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.733 HG12 HD23 ' A' ' 75' ' ' LEU . 11.2 m -73.22 115.01 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.431 0.634 . . . . 0.0 110.705 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.532 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.17 -11.95 17.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.607 -179.188 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.812 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 66.9 t0 -114.12 121.55 44.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.619 179.278 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.469 ' HA ' ' CD ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -70.59 -47.47 60.01 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.581 0.705 . . . . 0.0 109.456 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -85.03 16.49 3.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.057 178.491 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.812 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.8 p -46.14 144.53 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.153 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.101 179.909 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.6 OUTLIER -66.82 143.95 56.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 111.755 -179.033 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.866 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.0 mm -123.45 99.8 7.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.81 -1.087 . . . . 0.0 110.222 179.37 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.687 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 23.8 mtp180 -102.13 103.08 13.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.332 -178.658 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 34' ' ' LEU . 11.3 mt -98.85 135.6 40.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -164.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.113 179.343 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 14.4 0.92 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 179.681 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.62 -36.15 7.58 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.843 0.354 . . . . 0.0 110.886 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.407 ' CD2' ' HB3' ' A' ' 67' ' ' GLU . 75.3 m-70 -113.31 115.68 28.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.607 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.93 -14.36 42.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.827 -179.396 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -160.05 153.11 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.07 0.462 . . . . 0.0 112.131 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.866 ' CD1' HG21 ' A' ' 110' ' ' ILE . 45.0 p90 -133.19 171.41 14.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.168 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.42 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 3.6 mtt180 -157.37 160.3 38.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.213 0.53 . . . . 0.0 111.846 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.2 m95 -124.21 107.67 11.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.791 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.47 168.49 19.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.942 -178.303 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.73 -153.94 2.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.998 179.59 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 141' ' ' GLN . 12.4 tp -77.33 -41.6 39.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.828 0.347 . . . . 0.0 111.119 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.6 pt-20 -61.43 -50.23 73.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.619 -179.449 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.833 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.93 -45.8 63.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.87 0.366 . . . . 0.0 110.531 -179.47 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.499 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -56.89 -30.46 63.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 109.802 179.174 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.7 m -84.38 -31.98 24.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.271 178.634 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.833 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.01 -43.79 91.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.872 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.647 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.1 mt -77.72 -42.55 33.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.954 179.281 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.2 53.5 1.24 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.589 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.14 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 114.885 -1.052 . . . . 0.0 111.876 -178.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.5 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 40.9 m-85 -59.74 120.75 10.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.308 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -46.32 -52.27 13.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.301 0.572 . . . . 0.0 111.26 -179.453 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.797 ' HB3' HD13 ' A' ' 85' ' ' LEU . 15.9 mp0 -43.6 -54.39 4.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.829 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.667 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -66.39 -34.06 77.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.872 0.368 . . . . 0.0 110.584 -179.498 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.91 -35.32 74.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.408 179.545 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.42 -45.29 22.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.794 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.778 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.84 -55.38 23.48 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.114 179.487 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.667 HD12 ' O ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -63.8 -27.56 69.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.455 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.529 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -68.99 -51.77 35.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.029 -179.9 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.588 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 71.1 mm-40 -71.26 -30.96 66.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 143' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.32 -47.63 88.45 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.651 179.105 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.506 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 29.8 t-80 -74.58 -31.69 62.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.803 0.335 . . . . 0.0 110.435 179.192 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.68 -53.2 51.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.348 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.16 -48.9 78.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.747 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.614 HD11 ' HB3' ' A' ' 100' ' ' LEU . 79.3 mt -60.91 -26.99 67.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.532 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 148' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.7 t -76.04 -17.13 59.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.782 0.325 . . . . 0.0 110.792 179.443 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.333 -0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.598 -179.766 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.461 0.124 0 CA-C-O 121.062 0.458 . . . . 0.0 111.351 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.801 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -118.22 137.19 53.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.309 179.565 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.867 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.65 115.74 24.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.146 -179.665 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -126.84 174.59 8.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.679 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -164.04 124.91 2.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.164 0.507 . . . . 0.0 111.186 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.672 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.94 175.88 15.9 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.789 HD11 HD23 ' A' ' 61' ' ' LEU . 1.2 mt -128.99 119.4 24.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.466 0.633 . . . . 0.0 112.693 -178.936 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.572 HD11 ' HB3' ' A' ' 98' ' ' TYR . 14.2 mm -77.0 91.61 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.225 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.987 HD11 HG23 ' A' ' 64' ' ' THR . 58.7 mt -88.01 141.83 13.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.601 -178.287 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.814 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 54.8 p90 -152.23 122.42 7.16 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -179.116 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 ptt85 -83.69 114.31 21.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.251 179.31 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.95 -179.546 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 121.028 0.442 . . . . 0.0 111.668 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.824 ' HB ' ' HE2' ' A' ' 144' ' ' HIS . 4.1 mt -106.29 143.54 17.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.113 -179.05 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.751 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.6 OUTLIER -137.28 132.94 34.43 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.244 179.45 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.66 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 45.0 m-85 -94.75 143.52 26.38 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.072 0.463 . . . . 0.0 112.233 -178.682 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.652 HD21 ' CB ' ' A' ' 68' ' ' ALA . 50.0 tp -79.59 132.87 36.39 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.339 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.572 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.7 mt -135.04 140.71 45.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.648 179.833 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 112' ' ' LEU . 8.7 mt -117.86 123.79 46.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 -178.987 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.495 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 1.2 tt0 -68.59 151.71 46.36 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.135 -179.414 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.16 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.344 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.4 p80 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 120.815 0.341 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.507 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 26.8 m95 -103.05 110.31 22.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.386 179.733 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.644 ' HB ' ' HE2' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -126.91 128.47 24.21 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.778 -179.323 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.573 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 49.2 Cg_exo -55.9 168.18 1.93 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.326 2.017 . . . . 0.0 112.493 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.65 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 15.2 Cg_endo -59.79 101.04 0.14 Allowed 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 123.148 2.565 . . . . 0.0 112.875 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE2' ' HB ' ' A' ' 44' ' ' THR . 4.7 mtmt -103.52 129.57 50.73 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.852 0.358 . . . . 0.0 111.093 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.55 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.13 -179.37 20.25 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.345 179.744 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -120.02 104.84 10.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 110.69 179.692 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.867 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -76.2 129.04 37.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.042 0.449 . . . . 0.0 111.193 -179.138 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.667 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -92.4 177.01 2.28 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.539 -179.596 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.667 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.0 Cg_exo -57.42 -60.25 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.684 2.256 . . . . 0.0 112.72 -178.992 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.54 0.13 88.41 Favored Glycine 0 CA--C 1.517 0.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.694 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.606 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 17.6 tt0 -78.73 171.98 14.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.35 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.4 t70 -98.6 158.69 15.44 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.208 0.527 . . . . 0.0 110.056 178.896 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.556 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.755 -179.074 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' CD2' ' A' ' 99' ' ' TRP . 33.1 tp -65.2 -39.04 92.3 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.668 0.27 . . . . 0.0 111.223 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.998 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -49.1 -45.38 43.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.665 179.675 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.551 HG21 ' N ' ' A' ' 50' ' ' VAL . 66.6 m -59.83 -48.62 80.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.33 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -64.64 -28.02 69.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.158 178.694 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.2 mt -76.35 -51.67 11.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.25 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -63.08 -35.18 79.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.55 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.72 -38.23 88.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.269 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.987 HG23 HD11 ' A' ' 15' ' ' ILE . 56.2 m -56.15 -51.21 68.8 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.593 179.133 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.471 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.3 pt20 -76.03 -21.97 56.26 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.961 179.622 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 0.9 OUTLIER -75.9 -35.89 59.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.214 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.65 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 2.8 mm-40 -112.04 -4.99 14.33 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.652 ' CB ' HD21 ' A' ' 32' ' ' LEU . . . -136.92 -6.65 1.87 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 179.697 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.548 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 72.94 -7.73 9.11 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.219 -0.991 . . . . 0.0 113.804 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.737 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.0 OUTLIER -96.6 129.14 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.005 0.431 . . . . 0.0 111.161 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.9 pt-20 -110.63 170.2 8.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 -179.682 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.13 -36.3 5.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.156 179.452 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.87 -24.04 74.27 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.53 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.493 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.8 mm100 -97.1 -4.04 40.14 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.676 -0.308 . . . . 0.0 111.485 -179.673 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.59 -170.93 2.48 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.898 0.38 . . . . 0.0 110.257 178.128 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.569 ' H ' ' H ' ' A' ' 102' ' ' GLU . 34.6 m -133.65 100.06 4.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.605 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.603 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 12.2 mm -72.26 113.11 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.732 -179.608 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.766 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.2 mp -73.49 144.95 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.845 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -100.17 148.96 24.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.205 -179.65 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.1 -17.44 57.09 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.714 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.512 ' CD2' HD11 ' A' ' 100' ' ' LEU . 30.5 t80 -100.3 102.45 13.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -126.02 135.59 51.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.004 0.431 . . . . 0.0 110.42 179.366 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -163.56 145.93 9.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.574 179.962 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.924 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -136.15 116.43 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.983 0.421 . . . . 0.0 111.908 179.88 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.92 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.9 mt -77.73 119.17 20.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.956 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -112.82 119.98 39.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.862 -179.281 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.552 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.8 p90 -167.28 144.34 4.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.258 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.628 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.2 p -81.84 115.38 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.416 0.627 . . . . 0.0 110.387 179.156 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.72 -98.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.938 -178.309 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB2' HH11 ' A' ' 90' ' ' ARG . 0.0 OUTLIER -78.39 -35.55 47.09 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.099 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.564 ' O ' ' HE2' ' A' ' 92' ' ' LYS . 1.1 m-20 -174.6 18.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.359 179.616 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.801 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -150.77 128.39 5.67 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-O 120.992 0.425 . . . . 0.0 110.883 -179.94 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.735 ' O ' HD12 ' A' ' 8' ' ' LEU . 60.3 Cg_endo -74.09 118.32 5.35 Favored 'Trans proline' 0 CA--C 1.509 -0.768 0 C-N-CA 123.397 2.732 . . . . 0.0 112.973 -179.293 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.5 ttpt -101.53 121.82 42.68 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.168 -179.373 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.1 m -86.69 108.06 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 178.272 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.71 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 30.0 t -105.92 108.19 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.706 -178.591 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.924 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.92 124.75 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.31 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.572 ' HB3' HD11 ' A' ' 14' ' ' ILE . 35.9 m-85 -110.72 130.83 55.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.847 -178.203 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CD2' HD13 ' A' ' 57' ' ' LEU . 6.3 m-90 -116.49 150.54 37.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.783 178.43 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 26.2 mt -78.89 132.88 36.94 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -139.98 140.96 36.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.994 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.569 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.4 tt0 -123.91 113.43 18.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.751 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.831 HG12 HD23 ' A' ' 75' ' ' LEU . 17.1 m -72.21 110.23 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 121.416 0.627 . . . . 0.0 110.396 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -58.56 -13.48 5.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.918 -179.038 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 65.0 t0 -108.26 114.76 28.88 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.025 0.441 . . . . 0.0 111.526 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 106' ' ' TYR . . . . . 0.42 ' CE1' ' CD ' ' A' ' 17' ' ' ARG . 0.5 OUTLIER -61.91 -42.54 99.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.121 179.357 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -96.58 25.23 5.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.103 179.014 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.7 p -49.33 147.28 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.347 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.444 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.7 pm0 -72.43 142.73 48.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.321 0.581 . . . . 0.0 110.822 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.858 HG21 ' CG ' ' A' ' 119' ' ' TYR . 44.4 mm -121.48 98.69 6.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.548 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.99 101.89 13.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.531 -179.169 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 34' ' ' LEU . 4.5 mt -92.07 160.81 15.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.016 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.21 -170.82 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.649 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -66.34 -34.67 78.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.324 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.19 -6.4 49.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.591 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.582 ' CB ' ' HB3' ' A' ' 112' ' ' LEU . 3.1 m-70 -110.93 127.86 55.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 111.131 -179.671 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.454 ' CG ' ' HG2' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -99.41 -23.2 15.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.068 179.892 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.4 -177.57 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 111.956 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.858 ' CG ' HG21 ' A' ' 110' ' ' ILE . 40.7 p90 -147.44 169.51 19.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.186 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 96.5 mtt180 -153.89 154.72 34.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.236 0.541 . . . . 0.0 111.63 -179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -119.31 107.06 12.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.468 178.698 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.72 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.28 169.31 18.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.102 0.477 . . . . 0.0 111.632 -178.144 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.42 -154.05 1.58 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.731 179.499 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.0 tp -76.79 -42.55 40.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.864 0.364 . . . . 0.0 111.359 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.8 pt-20 -63.08 -47.16 84.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.819 -179.268 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.732 ' O ' HD12 ' A' ' 130' ' ' LEU . 0.3 OUTLIER -74.54 -38.83 62.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.941 0.401 . . . . 0.0 110.544 -179.741 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.689 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -64.29 -29.52 70.61 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.496 0.665 . . . . 0.0 109.209 178.465 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.426 ' SG ' ' HG3' ' A' ' 137' ' ' LYS . 43.9 m -84.01 -36.35 23.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.611 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.8 OUTLIER -59.35 -44.79 92.63 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.742 -179.95 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -75.85 -39.69 56.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.701 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.494 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.9 52.59 1.26 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.176 178.082 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 132' ' ' GLN . . . . . 0.414 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.92 -31.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.59 -178.815 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.72 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 25.5 m-85 -63.18 121.29 13.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.705 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 134' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 137' ' ' LYS . 9.3 tttt -46.48 -54.31 9.5 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.158 0.504 . . . . 0.0 111.853 -179.494 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.92 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.0 mp0 -41.29 -54.92 2.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.1 -179.24 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.682 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.23 -30.92 71.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.331 . . . . 0.0 110.613 179.875 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -58.07 -36.58 73.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.899 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -76.99 -46.95 22.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.215 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -50.81 -50.82 55.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.074 0.464 . . . . 0.0 110.209 179.724 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.689 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.8 OUTLIER -72.15 -32.01 66.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.994 178.798 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.74 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.2 OUTLIER -59.06 -51.99 67.66 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.893 -179.753 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' HE2' ' A' ' 81' ' ' PHE . 1.5 mt-10 -69.57 -27.6 65.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.366 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.91 -48.62 65.92 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.916 179.42 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 144' ' ' HIS . . . . . 0.824 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.6 OUTLIER -80.7 -32.72 35.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.078 0.466 . . . . 0.0 110.325 179.551 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 145' ' ' GLN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 11.6 tp-100 -65.96 -52.62 48.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.972 -179.636 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -61.63 -53.48 55.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.622 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' A' ' 16' ' ' PHE . 92.8 mt -57.61 -29.94 64.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.463 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -24.46 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.546 179.549 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.24 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.516 -0.347 0 CA-C-O 121.363 0.602 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.048 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.6 131.58 54.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.282 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.757 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtm180 -81.89 128.35 33.95 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.836 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.32 156.27 44.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.852 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.556 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 56.9 m -149.3 124.06 9.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.002 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.66 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.44 168.91 13.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.672 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.79 HD11 HD23 ' A' ' 61' ' ' LEU . 1.5 mt -118.99 117.68 29.44 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.833 -179.094 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.978 HD11 ' HB1' ' A' ' 139' ' ' ALA . 38.7 mt -82.18 92.37 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.649 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 27.7 mt -86.39 145.57 7.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.783 -177.881 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.832 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.3 p90 -150.83 123.67 8.64 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -178.967 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.545 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -82.1 112.53 19.23 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HD3' HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.046 -179.858 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.826 0.346 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ILE . . . . . 0.832 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.9 mt -98.64 147.26 7.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.205 0.526 . . . . 0.0 112.143 -178.839 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.654 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.9 mt-10 -138.92 124.68 19.7 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.776 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.693 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.1 m-85 -88.76 147.1 24.64 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.657 HD13 ' CE2' ' A' ' 121' ' ' TRP . 45.5 tp -85.87 132.62 34.06 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.843 178.828 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.51 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 4.4 mt -133.03 144.55 50.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.878 0.37 . . . . 0.0 110.757 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.677 HD11 ' HG3' ' A' ' 46' ' ' PRO . 63.4 mt -123.31 106.71 10.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.052 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -60.02 139.05 57.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.504 179.347 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 . . . . . 0 CA--C 1.519 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.654 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 54.9 m95 -100.05 157.94 16.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.093 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.6 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -173.19 130.62 0.57 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.221 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 75.0 Cg_exo -50.99 169.12 0.19 Allowed 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.025 1.817 . . . . 0.0 112.091 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' PRO . . . . . 0.864 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 16.5 Cg_exo -64.25 81.14 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.492 2.128 . . . . 0.0 111.847 179.606 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -104.55 151.92 23.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.133 -179.786 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.536 ' O ' ' HB1' ' A' ' 10' ' ' ALA . . . -134.65 -172.69 12.87 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.592 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 49' ' ' HIS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 9.4 p-80 -109.74 110.82 21.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.713 0.292 . . . . 0.0 110.456 179.636 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.757 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.8 p -79.71 132.97 30.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.507 0.67 . . . . 0.0 111.135 -179.083 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.773 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.9 tt0 -91.03 152.79 44.6 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.516 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 19.6 Cg_endo -57.17 -15.86 19.65 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.647 2.231 . . . . 0.0 112.525 -179.292 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.773 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -106.23 -11.44 27.63 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 178.982 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -87.83 170.92 10.77 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ASP . . . . . 0.977 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -87.52 162.08 17.42 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' ASP . . . . . 0.513 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 9.6 m-20 -73.91 -63.5 1.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.864 -179.368 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.588 HD21 HG21 ' A' ' 77' ' ' ILE . 23.3 tp -64.63 -39.06 93.03 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.685 0.279 . . . . 0.0 110.639 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.977 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.76 -45.71 59.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.653 179.277 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.556 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 92.4 m -59.5 -43.46 93.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.199 0.523 . . . . 0.0 109.655 179.513 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.554 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.39 -29.73 65.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.194 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.819 HD22 ' HB2' ' A' ' 72' ' ' ALA . 94.1 mt -74.9 -52.97 9.9 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.038 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.13 -38.08 85.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.641 -179.849 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.8 76.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.025 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 40.9 m -62.58 -54.71 35.59 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.572 179.44 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.47 -25.03 61.28 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.697 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 3.2 mm-40 -78.06 -33.55 50.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.076 179.53 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HB3' HD13 ' A' ' 34' ' ' LEU . 57.3 mt-10 -112.9 6.94 18.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.959 -179.173 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.628 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.01 -7.21 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.795 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.604 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 72.62 -3.24 26.91 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.461 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.663 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -101.02 120.69 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-O 121.154 0.502 . . . . 0.0 110.97 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.1 pt-20 -106.15 170.69 7.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.198 -179.217 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.868 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.56 -33.03 13.86 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.124 0.488 . . . . 0.0 110.251 179.064 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.507 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -70.66 -11.46 68.95 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.479 179.837 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.414 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 7.7 mm-40 -113.7 -13.47 12.68 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.822 0.311 . . . . 0.0 111.053 179.286 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.868 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -120.32 -173.13 2.5 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.805 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.576 ' H ' ' H ' ' A' ' 102' ' ' GLU . 33.8 m -131.62 98.12 4.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.384 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.735 HD12 HD21 ' A' ' 13' ' ' LEU . 14.8 mm -70.64 102.17 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.361 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.616 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -65.3 140.02 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 110.437 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -97.83 150.97 20.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.555 -179.658 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.13 -21.85 38.49 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.651 179.634 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.55 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.3 t80 -108.93 126.17 52.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.816 0.341 . . . . 0.0 111.368 -179.59 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.687 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.8 134.29 8.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.188 179.51 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -157.78 145.66 18.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.873 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -123.48 136.18 54.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 179.561 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.904 HD13 ' CB ' ' A' ' 135' ' ' GLU . 10.8 mt -100.01 119.09 37.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.097 179.761 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -109.7 118.64 37.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.466 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.536 ' CD2' ' HG2' ' A' ' 135' ' ' GLU . 17.1 p90 -167.22 147.41 5.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.012 179.748 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.636 HG23 ' C ' ' A' ' 92' ' ' LYS . 9.9 p -83.81 112.88 21.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 179.232 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.85 -100.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.761 -178.494 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -45.84 88.99 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.143 0.497 . . . . 0.0 110.241 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 91' ' ' ASN . . . . . 0.523 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -174.74 21.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.218 179.531 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 1.048 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.8 tptt -151.25 130.91 6.73 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.868 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.2 Cg_endo -67.74 118.61 5.73 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.388 2.725 . . . . 0.0 112.554 -179.436 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 1.016 ' HG2' HD13 ' A' ' 8' ' ' LEU . 8.5 mtpp -106.15 123.37 47.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.65 -178.881 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.8 m -89.21 105.75 17.99 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.292 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.718 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 20.3 t -105.7 108.19 24.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.819 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.873 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -87.41 126.55 41.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 178.062 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' TYR . . . . . 0.784 ' HB3' HG13 ' A' ' 14' ' ' ILE . 39.1 m-85 -114.9 128.88 56.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.109 0.481 . . . . 0.0 111.76 -178.775 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 99' ' ' TRP . . . . . 0.687 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -113.29 147.24 37.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.106 179.198 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.616 HD12 HG21 ' A' ' 78' ' ' ILE . 12.9 mt -78.37 132.93 37.58 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 101' ' ' ALA . . . . . 0.647 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -142.71 144.57 32.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.908 0.385 . . . . 0.0 111.286 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.576 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.3 tm-20 -124.6 114.7 19.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.491 179.153 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.76 HG12 HD23 ' A' ' 75' ' ' LEU . 5.1 m -71.85 123.7 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-O 121.376 0.607 . . . . 0.0 110.065 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 1.4 mttm -60.13 -28.58 68.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.29 -177.968 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 105' ' ' ASP . . . . . 0.718 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.3 t0 -102.11 121.35 42.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 0.0 111.722 -178.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -43.63 94.28 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.81 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -99.66 25.9 6.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.703 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.718 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.8 p -42.99 151.39 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.332 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 6.3 pm0 -69.95 141.85 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.174 0.511 . . . . 0.0 111.233 -179.209 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.851 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.3 mm -120.34 98.01 5.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.808 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 111' ' ' ARG . . . . . 0.604 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 3.3 mtp180 -98.32 97.51 8.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.554 -179.128 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.641 HD22 HD22 ' A' ' 34' ' ' LEU . 10.2 mt -92.66 125.51 37.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 115' ' ' GLU . 54.5 m -82.8 -166.38 1.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.357 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -75.7 19.47 0.2 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.64 0.257 . . . . 0.0 111.329 179.784 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 115' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 113' ' ' SER . 50.7 mt-10 -105.26 -34.11 7.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.788 0.327 . . . . 0.0 110.626 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 11.0 m80 -118.1 137.32 53.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -85.27 -27.29 26.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.842 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.0 174.35 6.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 111.583 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.851 ' CD1' HG21 ' A' ' 110' ' ' ILE . 23.6 p90 -136.97 174.01 11.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.509 -179.266 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HG3' ' CH2' ' A' ' 43' ' ' TRP . 1.7 mtt-85 -157.94 162.38 38.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.215 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 121' ' ' TRP . . . . . 0.657 ' CE2' HD13 ' A' ' 32' ' ' LEU . 91.0 m95 -131.0 107.16 8.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.861 179.35 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.89 172.36 12.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.012 0.434 . . . . 0.0 111.42 -178.838 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.81 -151.7 5.95 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.732 -0.746 . . . . 0.0 111.665 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 141' ' ' GLN . 5.5 tp -77.53 -39.74 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.797 0.332 . . . . 0.0 111.187 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -63.03 -50.62 69.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.797 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 126' ' ' GLU . . . . . 0.825 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -71.39 -46.9 59.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.111 -179.564 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.11 -27.55 54.29 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.225 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 128' ' ' CYS . . . . . 0.498 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -82.5 -31.77 29.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.647 178.58 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 129' ' ' GLN . . . . . 0.641 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -65.99 -45.24 82.34 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.096 -179.676 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.654 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -78.47 -40.01 36.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.359 179.239 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.55 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -73.72 49.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.771 179.583 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.82 -31.23 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.151 -179.182 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -61.6 118.75 7.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.83 0.348 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -46.24 -38.11 8.06 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.904 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.8 mp0 -59.65 -56.98 15.08 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.273 -179.391 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 136' ' ' MET . . . . . 0.6 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -54.33 -45.13 72.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.028 -179.406 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 137' ' ' LYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.06 -35.3 46.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.591 179.672 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.47 -46.51 22.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.681 179.882 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 139' ' ' ALA . . . . . 0.978 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.11 -48.36 67.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.442 179.425 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -74.48 -25.98 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.092 178.854 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.46 -51.83 52.65 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.09 179.942 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 142' ' ' GLU . . . . . 0.499 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 10.0 mm-40 -69.93 -28.74 65.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.513 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.8 93.01 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.04 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -76.11 -28.84 57.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.342 179.394 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -70.6 -50.1 40.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.091 -179.888 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -67.8 -52.08 41.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.149 -179.667 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.461 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.1 mt -57.27 -27.71 62.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.529 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.53 -21.73 66.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.683 179.804 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.197 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.895 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.507 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -72.39 92.06 0.76 Allowed 'Trans proline' 0 N--CA 1.447 -1.243 0 C-N-CA 124.329 3.353 . . . . 0.0 109.617 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.59 149.05 40.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 0.0 111.022 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.36 -15.06 0.9 Allowed Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.347 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.2 p -85.7 111.76 20.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.937 0.369 . . . . 0.0 111.05 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.465 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 11.3 tpt -87.6 124.43 33.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.964 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 71.1 167.41 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.214 0.53 . . . . 0.0 111.399 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -106.53 139.2 41.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.788 -179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.627 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.37 125.37 33.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.13 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.565 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -136.09 167.01 22.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.744 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.502 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -157.83 123.89 4.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.079 0.466 . . . . 0.0 111.18 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.534 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.7 169.72 13.14 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.035 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.748 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -124.64 117.75 24.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.63 0.252 . . . . 0.0 111.596 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.031 HD11 ' HB1' ' A' ' 139' ' ' ALA . 23.7 mt -85.95 91.99 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.957 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.46 146.02 7.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.874 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.608 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 45.8 p90 -150.04 125.2 10.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.701 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.77 113.53 24.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.798 0.332 . . . . 0.0 110.343 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 18' ' ' ARG . 12.6 ttp180 -89.54 117.56 28.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -73.36 160.28 32.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.744 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.439 ' HG ' HG23 ' A' ' 21' ' ' ILE . 35.0 tp -55.24 -82.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.375 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.439 HG23 ' HG ' ' A' ' 20' ' ' LEU . 2.8 pp -110.86 156.13 41.24 Favored Pre-proline 0 C--N 1.333 -0.137 0 CA-C-O 120.738 0.304 . . . . 0.0 111.376 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.83 157.53 58.52 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.694 2.262 . . . . 0.0 112.16 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' HE2' ' CD1' ' A' ' 21' ' ' ILE . 3.5 mmtt -106.43 -78.33 0.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.622 ' O ' HG12 ' A' ' 24' ' ' VAL . 20.9 t -93.19 12.55 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.436 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.69 14.91 9.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.281 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -111.57 -75.06 0.62 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.951 0.405 . . . . 0.0 110.559 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 12.6 m120 -88.66 175.99 7.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.506 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 27' ' ' ASN . . . 177.19 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.92 0.391 . . . . 0.0 111.184 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.5 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -105.76 148.03 10.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.329 0.585 . . . . 0.0 111.847 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.608 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 8.4 mt-10 -122.34 173.78 7.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.863 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 34.0 m-85 -138.55 133.56 32.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.63 0.252 . . . . 0.0 111.35 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.2 tp -76.8 133.21 39.46 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.584 HD22 ' HB3' ' A' ' 43' ' ' TRP . 5.4 mt -132.98 144.53 50.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.98 0.419 . . . . 0.0 111.019 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 112' ' ' LEU . 54.3 mt -123.13 116.54 23.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.478 HE21 ' HZ2' ' A' ' 43' ' ' TRP . 15.9 tt0 -74.55 132.35 41.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.184 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -56.64 151.09 14.46 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.04 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 2.2 p -82.77 1.4 39.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.426 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -171.0 -175.3 1.7 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.726 0.298 . . . . 0.0 110.926 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.9 -130.45 11.59 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.507 ' O ' HG12 ' A' ' 40' ' ' ILE . 14.8 tt -83.94 -1.53 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.806 0.336 . . . . 0.0 111.312 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 60.13 34.7 21.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.016 0.436 . . . . 0.0 110.468 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.8 p80 -65.14 158.36 26.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.788 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.584 ' HB3' HD22 ' A' ' 33' ' ' LEU . 72.6 m95 -108.27 123.09 48.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.4 p -147.11 151.28 40.72 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.741 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.504 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 41.7 Cg_endo -66.79 168.3 17.25 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.493 2.128 . . . . 0.0 111.86 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.556 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 36.1 Cg_exo -60.3 99.53 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.588 2.192 . . . . 0.0 112.775 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 4.4 pttt -106.83 140.1 40.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.683 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.36 178.42 16.76 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.628 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.71 94.22 5.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.791 0.329 . . . . 0.0 110.666 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.675 ' N ' HG21 ' A' ' 59' ' ' THR . 1.7 p -69.56 132.13 33.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.068 0.461 . . . . 0.0 111.031 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.539 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.3 tt0 -95.35 151.88 38.96 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.119 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.539 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.3 Cg_endo -49.38 -33.08 28.18 Favored 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.682 2.255 . . . . 0.0 112.585 -179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.521 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -90.4 -13.38 60.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.345 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -87.67 165.12 15.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.553 0.216 . . . . 0.0 110.528 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.899 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 33.8 t70 -82.79 161.34 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.078 0.466 . . . . 0.0 110.711 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.5 -63.62 1.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.689 HD21 HG21 ' A' ' 77' ' ' ILE . 15.5 tp -61.87 -40.12 94.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.491 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.899 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -50.81 -50.06 57.14 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.675 HG21 ' N ' ' A' ' 50' ' ' VAL . 86.7 m -54.88 -36.81 65.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.502 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -75.22 -32.09 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.043 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -72.03 -53.03 14.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.641 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 8.5 ttt-85 -59.02 -43.61 91.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.416 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.61 70.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.279 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.957 HG23 HD11 ' A' ' 15' ' ' ILE . 27.2 m -62.93 -53.78 48.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.328 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.499 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.4 pt20 -74.17 -23.05 59.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.726 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.47 -37.46 36.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -110.07 9.84 24.1 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.81 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.714 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -153.25 -14.55 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.536 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 80.2 -6.41 60.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.578 HG21 HD23 ' A' ' 75' ' ' LEU . 2.6 mt -98.03 127.41 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.8 pt-20 -107.5 170.3 8.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.867 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.62 -31.34 10.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.9 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.46 -21.03 79.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.184 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -97.38 -5.6 35.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.648 0.261 . . . . 0.0 111.069 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.867 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.03 -167.82 1.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.781 0.324 . . . . 0.0 110.292 179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -140.02 97.48 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.897 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.689 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -70.77 112.83 6.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.018 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.97 134.6 29.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -94.26 151.28 19.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.36 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.81 -21.98 40.14 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.524 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.819 ' CE1' HD21 ' A' ' 100' ' ' LEU . 18.9 t80 -106.29 126.55 52.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.798 0.333 . . . . 0.0 110.869 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.75 125.97 5.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.083 0.468 . . . . 0.0 111.55 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -152.45 136.47 16.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.905 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.995 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -118.74 143.9 46.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.082 0.468 . . . . 0.0 111.651 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.895 HD13 ' HB3' ' A' ' 135' ' ' GLU . 3.8 mt -100.47 124.73 46.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.137 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -114.95 120.17 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.021 -179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 9.0 p90 -167.07 144.83 4.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.122 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.9 p -83.99 109.0 16.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.834 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -70.78 -93.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.435 ' HG3' ' OD1' ' A' ' 91' ' ' ASN . 12.8 ptt85 -74.8 -48.17 26.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.857 0.36 . . . . 0.0 110.351 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.435 ' OD1' ' HG3' ' A' ' 90' ' ' ARG . 20.2 p-10 -171.47 30.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.669 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.779 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.37 125.58 2.65 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.557 179.62 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.845 ' O ' HD12 ' A' ' 8' ' ' LEU . 52.6 Cg_endo -68.08 117.79 5.17 Favored 'Trans proline' 0 CA--C 1.513 -0.571 0 C-N-CA 123.273 2.649 . . . . 0.0 112.816 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -101.5 124.35 47.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.741 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 32.7 m -90.53 112.04 23.57 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 32.5 t -109.06 108.96 26.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.642 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.995 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.68 142.89 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.504 ' CE1' ' HG2' ' A' ' 45' ' ' PRO . 7.7 m-85 -126.3 133.61 51.36 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.581 ' CH2' HG21 ' A' ' 97' ' ' ILE . 14.5 m-90 -124.07 143.34 50.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.444 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.819 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -80.96 128.53 33.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.224 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -134.43 142.17 47.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.178 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 10.9 tt0 -119.5 115.28 23.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.646 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.792 HG12 HD23 ' A' ' 75' ' ' LEU . 11.9 m -72.24 129.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 121.304 0.574 . . . . 0.0 110.653 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' CD ' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.69 -27.1 68.46 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.794 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.477 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 1.3 m-20 -106.35 132.77 52.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.111 0.481 . . . . 0.0 111.969 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -69.09 -43.25 74.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.458 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -100.21 24.02 9.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.811 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 2.9 p -41.89 147.22 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' CD ' ' A' ' 111' ' ' ARG . 0.4 OUTLIER -61.75 144.64 54.37 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.306 0.574 . . . . 0.0 110.768 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.907 HG21 ' CD1' ' A' ' 119' ' ' TYR . 30.5 mm -124.26 96.81 4.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.928 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.536 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 15.2 mtp180 -106.77 99.77 9.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.97 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 34' ' ' LEU . 8.3 mt -85.68 172.86 10.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.528 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.11 -172.72 2.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.847 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -60.13 -29.57 68.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.09 -6.98 52.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.779 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.457 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 52.9 m80 -142.05 127.88 19.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.0 110.995 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.401 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -101.26 -18.94 15.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.513 -179.771 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.03 163.67 39.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 111.43 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.907 ' CD1' HG21 ' A' ' 110' ' ' ILE . 38.5 p90 -138.25 175.16 9.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.713 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.421 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 4.1 mtt85 -158.68 158.66 34.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 0.0 111.509 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CE2' HD13 ' A' ' 32' ' ' LEU . 87.5 m95 -127.1 106.74 9.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.62 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -138.15 167.62 21.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.066 0.46 . . . . 0.0 111.585 -178.716 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.74 -153.51 3.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.707 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.03 -46.69 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.843 0.322 . . . . 0.0 110.845 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.2 pt-20 -56.14 -49.34 74.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.9 -50.68 22.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.551 -179.503 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.38 -29.63 10.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 2.3 m -83.94 -33.94 24.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.392 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.29 -41.43 94.12 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.585 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.554 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -77.6 -44.33 28.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.88 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.88 52.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.142 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.501 ' NE2' ' O ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -37.8 -34.11 0.1 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.131 -179.377 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.478 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 21.2 m-85 -54.8 114.77 1.84 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.127 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -45.8 -50.81 13.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.519 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.895 ' HB3' HD13 ' A' ' 85' ' ' LEU . 11.3 mp0 -46.03 -46.97 16.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.624 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.583 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -71.36 -45.24 63.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.696 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.61 -30.24 12.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -79.77 -47.01 15.94 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.842 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 1.031 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.61 -47.47 63.6 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.032 0.444 . . . . 0.0 110.423 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.583 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -73.86 -27.67 61.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.024 178.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.553 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -67.19 -51.45 53.42 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.639 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -67.06 -30.74 70.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.55 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.5 -56.62 22.66 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.948 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -67.78 -28.26 67.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.771 0.319 . . . . 0.0 110.45 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -68.55 -43.71 76.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -72.67 -52.58 14.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.256 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.574 HD11 ' CE2' ' A' ' 16' ' ' PHE . 32.2 mt -52.23 -34.84 47.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.658 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.6 t -90.5 -10.74 42.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.264 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.563 HD11 HD23 ' A' ' 147' ' ' LEU . 0.3 OUTLIER -95.74 -142.3 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 179.7 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -142.9 -68.52 0.35 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.938 0.399 . . . . 0.0 110.479 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -163.76 -42.59 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.089 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.946 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.834 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.545 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.39 -36.99 4.72 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.332 3.355 . . . . 0.0 109.624 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.8 142.68 58.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.077 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.42 -137.07 9.85 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.553 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 61.9 m -98.58 -18.51 18.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 0.0 110.994 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.404 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -58.27 172.9 0.4 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.929 0.395 . . . . 0.0 110.562 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.595 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 66.99 163.6 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.916 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.952 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -104.11 127.82 51.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.113 -179.719 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 121.83 25.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.024 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -138.74 160.52 39.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.827 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.9 m -148.19 123.66 10.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.237 0.541 . . . . 0.0 111.146 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.411 ' CA ' ' HB3' ' A' ' 47' ' ' LYS . . . -114.85 170.94 13.45 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.678 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.727 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -124.67 117.24 23.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.859 0.361 . . . . 0.0 110.798 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.863 HD11 ' HB1' ' A' ' 139' ' ' ALA . 62.8 mt -82.87 92.32 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.818 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.64 145.73 8.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.186 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.664 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 29.0 p90 -149.62 124.08 9.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.837 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.66 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -87.12 113.51 22.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.4 . . . . 0.0 110.654 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 18' ' ' ARG . 5.9 ttp85 -86.71 113.39 22.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.316 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -72.2 159.96 33.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.635 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.514 HD23 HG13 ' A' ' 21' ' ' ILE . 3.9 tp -59.83 -82.36 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.846 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.514 HG13 HD23 ' A' ' 20' ' ' LEU . 2.1 pp -114.54 148.39 40.17 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.661 0.267 . . . . 0.0 111.081 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 9.1 Cg_exo -72.06 158.77 51.66 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.831 2.354 . . . . 0.0 112.857 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -78.49 0.59 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.524 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' HG12 ' A' ' 24' ' ' VAL . 18.7 t -88.28 3.62 5.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.391 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 64.26 19.33 11.74 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.248 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -110.74 -71.6 0.76 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.874 0.369 . . . . 0.0 110.795 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -95.75 118.28 32.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.427 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -127.68 -48.47 1.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 0.0 111.446 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.664 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.0 mt -101.17 148.33 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.616 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 16.8 mp0 -134.86 134.27 40.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.725 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -96.35 150.04 21.03 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -82.97 135.93 34.71 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.098 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.54 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.2 mt -135.54 142.65 45.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.868 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.637 HD22 ' CD2' ' A' ' 112' ' ' LEU . 8.8 mt -123.29 113.63 19.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.08 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.9 tt0 -69.09 122.26 18.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.39 130.27 45.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.426 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 90.8 p -73.36 0.32 12.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.519 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -146.56 -164.98 2.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.485 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.87 -130.13 33.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.564 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.4 pt -95.58 9.22 5.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.512 0.196 . . . . 0.0 111.405 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.43 57.21 1.53 Allowed 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -107.45 150.44 26.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.832 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 10.1 m95 -95.84 139.21 32.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.05 136.64 9.41 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.748 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 73.7 Cg_exo -49.17 169.08 0.11 Allowed 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.781 1.654 . . . . 0.0 111.018 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 1.5 Cg_endo -78.16 101.06 1.43 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.027 1.818 . . . . 0.0 112.141 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HB3' ' CA ' ' A' ' 12' ' ' GLY . 0.3 OUTLIER -120.88 -173.11 2.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.46 -139.41 2.67 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.352 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -131.57 127.23 36.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.554 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 0.2 OUTLIER -81.6 135.51 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-O 120.95 0.405 . . . . 0.0 110.599 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CG ' ' HB2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -87.18 170.43 12.1 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.004 -179.727 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 76.8 Cg_exo -49.68 -63.29 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.793 2.328 . . . . 0.0 112.87 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.9 19.27 42.77 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.432 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 30.5 tt0 -90.6 160.77 15.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.976 0.388 . . . . 0.0 110.754 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.906 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -85.31 162.69 18.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.057 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.532 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -72.13 -62.98 1.24 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.086 0.47 . . . . 0.0 110.737 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD21 HG21 ' A' ' 77' ' ' ILE . 21.9 tp -61.97 -42.53 99.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.316 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.906 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.2 mt-10 -50.35 -46.87 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.73 0.3 . . . . 0.0 110.516 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.554 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 87.6 m -54.63 -37.36 65.56 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.09 -32.74 50.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.122 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.2 mt -70.95 -53.46 14.84 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.73 -38.86 89.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.038 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.53 -33.79 76.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.045 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.818 HG23 HD11 ' A' ' 15' ' ' ILE . 90.0 m -58.55 -51.92 67.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.393 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.544 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.63 -20.96 61.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.919 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.67 -41.67 30.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.755 0.312 . . . . 0.0 111.17 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.555 ' O ' HD13 ' A' ' 34' ' ' LEU . 13.8 mt-10 -108.08 6.34 26.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.614 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 46' ' ' PRO . . . -148.24 -7.96 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.625 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 70.95 -1.94 20.87 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.143 -1.027 . . . . 0.0 113.241 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.741 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.4 mt -100.92 127.67 53.86 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.042 0 CA-C-N 117.035 0.418 . . . . 0.0 110.811 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.1 pm0 -108.32 166.6 10.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.12 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.71 -34.55 5.24 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.734 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.41 -23.78 77.24 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.292 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.527 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 2.9 mm-40 -93.72 -5.83 47.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.395 0.14 . . . . 0.0 111.233 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.42 -171.35 2.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.996 0.427 . . . . 0.0 110.64 178.775 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.8 m -138.98 99.02 3.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.591 HG13 HD21 ' A' ' 61' ' ' LEU . 7.6 mm -71.58 120.38 19.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.448 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.33 131.33 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.221 0.534 . . . . 0.0 110.937 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -90.59 148.81 22.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.211 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.72 -24.32 30.03 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.285 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CE1' HD21 ' A' ' 100' ' ' LEU . 17.0 t80 -103.71 125.62 50.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.691 0.282 . . . . 0.0 110.864 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HD2' ' HZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.09 123.59 4.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 111.414 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.5 tpt85 -152.34 138.16 18.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.683 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.951 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.3 OUTLIER -114.69 134.02 55.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.429 -179.691 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.679 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.2 mt -91.11 122.67 33.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.524 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -115.89 123.49 48.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.33 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -167.05 142.03 4.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.823 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.2 p -82.02 109.86 16.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.622 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -77.29 -98.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.007 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -38.3 84.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 176.79 27.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.076 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.809 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -158.82 130.67 4.09 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.478 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.884 ' O ' HD12 ' A' ' 8' ' ' LEU . 47.6 Cg_endo -66.46 120.46 7.59 Favored 'Trans proline' 0 CA--C 1.516 -0.392 0 C-N-CA 123.381 2.721 . . . . 0.0 113.024 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.952 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -101.31 123.21 45.05 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.794 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -95.73 109.0 21.36 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 t -108.41 108.82 26.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.977 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.951 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.14 125.29 40.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.56 ' HB3' HG13 ' A' ' 14' ' ' ILE . 32.7 m-85 -111.74 165.43 12.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.532 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 4.7 m-90 -152.68 138.56 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.292 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.696 HD23 ' N ' ' A' ' 100' ' ' LEU . 0.3 OUTLIER -75.84 124.92 28.11 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.524 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.565 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -131.49 143.71 50.61 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.357 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.0 tt0 -117.6 110.67 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.766 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.758 HG12 HD23 ' A' ' 75' ' ' LEU . 10.9 m -72.27 143.55 13.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.386 0.613 . . . . 0.0 111.589 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.533 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 3.8 mptp? -71.59 -12.53 61.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.885 -177.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.561 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 6.5 t70 -133.35 127.61 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 111.931 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.66 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 59.7 t80 -62.54 -38.43 89.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -100.3 21.3 13.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.695 178.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -43.03 145.82 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.064 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.632 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -61.85 140.19 58.29 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.32 0.581 . . . . 0.0 110.621 -179.337 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.812 HG21 ' CG ' ' A' ' 119' ' ' TYR . 28.6 mm -123.74 95.2 3.2 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.879 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.625 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.1 mtp85 -95.3 102.32 14.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.158 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.637 ' CD2' HD22 ' A' ' 34' ' ' LEU . 11.4 mt -90.65 144.49 25.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.11 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -89.09 -156.27 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 7.0 11.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.449 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -99.12 -29.86 12.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.435 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.9 m80 -120.61 157.36 29.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.823 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -120.16 -21.4 7.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.694 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -154.59 178.6 9.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.914 0.388 . . . . 0.0 111.507 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.812 ' CG ' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -156.56 161.05 39.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.866 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.686 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -148.97 148.39 29.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.038 0.447 . . . . 0.0 111.383 179.588 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 81.2 m95 -105.96 106.9 17.62 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.3 169.71 17.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 0.0 111.666 -178.26 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.33 -151.83 3.93 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.763 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.54 -45.62 24.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.767 0.318 . . . . 0.0 111.351 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.47 -52.19 66.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.803 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.02 -46.7 67.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.558 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.54 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.54 -31.12 63.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.298 0.57 . . . . 0.0 109.763 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.4 m -82.57 -30.84 29.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.183 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.73 -43.55 88.7 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.725 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.636 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -77.73 -37.42 49.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.217 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.521 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.95 56.52 1.97 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.151 0.501 . . . . 0.0 110.085 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.438 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.57 -34.06 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.255 -179.464 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.423 ' HE2' " O4'" ' A' ' 154' ' ' ATP . 38.5 m-85 -59.5 115.32 3.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.185 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -46.17 -44.92 16.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.381 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.679 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.2 mp0 -49.31 -60.24 2.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.264 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.553 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -54.37 -40.23 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.921 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.416 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -53.41 -39.58 64.43 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.607 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.21 -44.39 30.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.378 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.19 -42.74 63.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.246 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -79.67 -29.52 40.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.015 178.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.607 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.3 OUTLIER -66.92 -52.24 45.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.823 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -66.22 -28.91 69.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.424 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.412 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.1 -53.67 42.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.833 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.61 ' NE2' HD12 ' A' ' 29' ' ' ILE . 18.0 t-80 -71.24 -30.23 66.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 0.0 110.106 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.82 -50.3 67.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.347 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.418 ' CE1' ' CD1' ' A' ' 150' ' ' ILE . 48.6 t80 -62.39 -52.08 65.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.738 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.803 HD23 HD11 ' A' ' 150' ' ' ILE . 67.6 mt -55.03 -30.18 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.5 t -83.02 -8.43 59.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.594 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.73 -22.45 14.4 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.299 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.803 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -67.24 -124.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 179.995 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.448 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 2.5 tp10 -97.1 -60.4 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 0.0 110.247 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -56.38 118.55 4.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.622 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.525 ' C ' ' H ' ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.542 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.32 26.32 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 124.294 3.329 . . . . 0.0 109.642 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.525 ' H ' ' C ' ' A' ' 1' ' ' GLY . 6.9 mp 59.56 -176.01 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.959 0.409 . . . . 0.0 111.123 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.52 -178.49 16.59 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.259 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.01 18.16 6.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.727 0.299 . . . . 0.0 111.098 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 ptm -61.06 168.38 2.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.975 0.416 . . . . 0.0 110.654 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.623 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 59.26 167.51 0.06 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.37 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.62 142.18 41.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.524 179.644 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.7 mtt180 -78.56 137.77 38.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.639 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.655 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -149.56 162.61 39.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.599 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 16.6 m -156.42 123.5 5.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.17 0.51 . . . . 0.0 111.54 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.62 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -113.47 178.0 18.29 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.555 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.742 HD11 HD23 ' A' ' 61' ' ' LEU . 1.1 mt -135.1 118.2 16.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.047 0.424 . . . . 0.0 111.801 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.497 HG12 ' HB3' ' A' ' 98' ' ' TYR . 11.2 mm -75.67 90.9 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.837 HD11 HG23 ' A' ' 64' ' ' THR . 30.2 mt -84.97 136.65 22.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.711 -178.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.687 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.9 p90 -146.47 124.05 11.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.828 -178.191 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.736 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.47 113.21 18.49 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.008 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -94.53 117.44 30.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.424 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.2 160.35 25.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.017 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.2 mt -59.07 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.022 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.778 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.8 pp -111.24 145.94 33.55 Favored Pre-proline 0 CA--C 1.53 0.173 0 CA-C-O 120.647 0.26 . . . . 0.0 111.163 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 7.0 Cg_exo -73.68 159.23 46.07 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.928 2.419 . . . . 0.0 112.604 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -78.7 0.59 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 24' ' ' VAL . 16.5 t -109.5 0.5 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.576 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 63.57 47.47 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.007 0.432 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.6 p-10 -114.2 -51.76 2.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.629 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 29' ' ' ILE . 3.9 m-20 -110.57 -75.57 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.177 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 65.41 -65.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.501 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.687 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 12.3 mt -102.88 147.71 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 111.485 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.4 mp0 -135.85 141.39 44.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.659 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.588 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 53.4 m-85 -103.37 149.71 24.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.927 0.394 . . . . 0.0 112.018 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 43.5 tp -84.02 136.64 33.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.3 mt -136.95 143.13 42.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.609 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 112' ' ' LEU . 19.9 mt -121.31 112.29 18.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.759 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.493 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 62.4 tt0 -60.68 134.22 56.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.315 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.59 133.44 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.626 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -80.66 5.58 15.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.526 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -168.56 -177.0 2.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.744 0.306 . . . . 0.0 110.652 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.82 -119.29 4.82 Favored Glycine 0 CA--C 1.521 0.417 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.636 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.615 HD11 ' HB3' ' A' ' 42' ' ' HIS . 3.6 pt -100.29 9.25 8.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.546 0.212 . . . . 0.0 111.471 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 61.69 37.4 15.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.453 0.644 . . . . 0.0 109.643 -178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.615 ' HB3' HD11 ' A' ' 40' ' ' ILE . 15.0 p-80 -86.09 170.98 11.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.659 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.524 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 45.6 m95 -115.69 112.61 22.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.959 0.409 . . . . 0.0 111.267 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -125.63 143.73 45.88 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.66 171.39 12.11 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.194 1.93 . . . . 0.0 111.97 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.432 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 25.2 Cg_endo -61.49 96.24 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.436 2.091 . . . . 0.0 112.109 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.687 ' O ' ' HB1' ' A' ' 63' ' ' ALA . 7.3 mttt -86.63 170.64 11.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -166.58 128.58 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.696 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.69 109.91 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.713 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -79.42 137.02 22.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.097 0.475 . . . . 0.0 111.15 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 4.1 tt0 -95.12 151.48 38.82 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.277 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 7.4 Cg_endo -52.57 -31.02 47.45 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.71 2.273 . . . . 0.0 112.88 -179.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -91.2 -13.38 58.86 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.508 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -87.24 161.44 18.0 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.53 0.205 . . . . 0.0 110.684 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 31.1 t70 -78.29 160.89 27.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.364 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 15.5 m-20 -71.6 -62.21 1.5 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.253 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.699 HD21 HG21 ' A' ' 77' ' ' ILE . 24.8 tp -62.32 -40.44 96.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.299 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -50.32 -45.01 54.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.733 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.543 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 90.2 m -60.06 -41.81 93.16 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.23 -31.3 69.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.785 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.904 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -73.5 -52.19 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.642 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -59.5 -44.09 93.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.57 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 47' ' ' LYS . . . -58.77 -37.1 75.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.046 0.45 . . . . 0.0 110.045 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.837 HG23 HD11 ' A' ' 15' ' ' ILE . 34.7 m -60.32 -54.02 50.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.562 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 10.7 pt20 -73.23 -21.7 60.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.915 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -79.32 -41.69 27.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.219 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 -106.1 2.58 27.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.722 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.59 -8.99 0.64 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.611 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 72.51 1.02 51.04 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.934 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.622 ' CG2' HD23 ' A' ' 75' ' ' LEU . 3.9 mt -103.7 122.23 56.12 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.7 pt-20 -107.24 168.55 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.441 -179.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.904 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.18 -36.13 8.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.507 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.62 78.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.109 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 0.2 OUTLIER -91.52 -6.6 52.25 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.704 0.288 . . . . 0.0 111.06 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -135.9 -176.2 4.23 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.86 0.362 . . . . 0.0 110.24 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.538 ' H ' ' H ' ' A' ' 102' ' ' GLU . 94.7 m -124.63 103.24 8.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.726 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.699 HG21 HD21 ' A' ' 57' ' ' LEU . 14.2 mm -77.63 109.79 12.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.905 0.383 . . . . 0.0 111.569 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.768 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -72.42 138.3 21.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.701 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -94.27 148.84 21.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.468 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.87 -23.09 34.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.736 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CD1' HD21 ' A' ' 100' ' ' LEU . 34.4 t80 -100.71 125.25 47.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.38 . . . . 0.0 111.075 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.48 126.09 5.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.176 0.512 . . . . 0.0 111.273 179.693 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -153.81 137.44 16.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.202 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.919 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -118.08 134.6 54.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 0.0 111.35 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.784 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.1 mt -101.62 117.82 35.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.481 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.24 126.51 53.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.144 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -166.93 140.23 3.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.646 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.6 p -80.41 108.82 14.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.557 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.732 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -76.62 -95.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.587 -178.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.496 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -69.98 -39.15 76.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.72 0.295 . . . . 0.0 110.875 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 6.2 t-20 176.41 29.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.853 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.646 ' N ' HG23 ' A' ' 88' ' ' VAL . 0.0 OUTLIER -157.65 123.99 2.51 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.737 179.785 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.6 Cg_endo -73.43 117.63 5.16 Favored 'Trans proline' 0 CA--C 1.515 -0.436 0 C-N-CA 123.025 2.483 . . . . 0.0 112.832 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 2.1 mmmt -103.0 121.73 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.349 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.549 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 55.2 m -88.74 113.61 24.49 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.74 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.9 t -112.44 109.41 28.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.222 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.919 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -84.92 130.14 36.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.497 ' HB3' HG12 ' A' ' 14' ' ' ILE . 37.4 m-85 -115.62 137.7 51.81 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.605 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.8 m-90 -125.92 143.83 50.92 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.113 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.768 HD12 HG21 ' A' ' 78' ' ' ILE . 6.2 mt -75.5 123.84 26.15 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.514 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.547 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -131.98 144.16 50.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.423 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.538 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.7 tt0 -123.64 112.63 17.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.601 0.238 . . . . 0.0 111.111 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.736 HG22 ' HG2' ' A' ' 17' ' ' ARG . 3.4 m -72.81 112.77 9.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.751 0.786 . . . . 0.0 110.387 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -8.78 14.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.517 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.876 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 6.1 m-20 -112.43 107.04 15.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.942 0.401 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CD1' ' HD2' ' A' ' 17' ' ' ARG . 2.7 t80 -55.47 -39.78 70.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -101.09 26.18 7.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.69 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.876 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.5 p -47.9 146.47 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.347 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.423 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 5.9 pm0 -68.68 143.09 54.86 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.118 0.485 . . . . 0.0 110.542 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.833 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.2 mm -120.97 97.55 5.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.511 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.611 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 19.5 mtp180 -101.84 99.92 10.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.435 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 34' ' ' LEU . 3.1 mt -92.06 -172.6 3.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.822 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.7 t -125.97 -172.57 2.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.811 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -66.58 -25.01 66.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.329 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.75 -12.53 60.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.29 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.413 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 81.7 m-70 -124.26 105.94 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.792 0.33 . . . . 0.0 110.764 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.52 -17.0 60.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.876 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.24 -179.57 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.126 0.489 . . . . 0.0 111.703 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.833 ' CD1' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -145.65 171.89 14.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.717 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 64.9 mtt180 -157.94 153.25 25.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.244 0.545 . . . . 0.0 111.675 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.566 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 90.6 m95 -118.03 107.14 13.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.367 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.771 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -136.63 173.59 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.045 0.45 . . . . 0.0 111.684 -178.555 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -79.94 -153.24 8.25 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.798 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.46 -41.16 40.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.0 pt-20 -61.05 -51.93 67.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.749 0.309 . . . . 0.0 111.413 -179.445 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.771 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.36 -48.72 60.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.904 0.383 . . . . 0.0 110.227 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.55 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -53.94 -27.25 29.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.411 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -83.23 -32.89 26.24 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.952 178.539 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.722 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.76 -46.99 82.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.66 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.4 OUTLIER -78.3 -37.19 45.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.512 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -75.36 52.22 0.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.069 0.461 . . . . 0.0 110.813 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.76 -32.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.62 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.539 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 26.0 m-85 -63.4 120.53 11.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.617 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.61 -49.41 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.006 0.431 . . . . 0.0 111.175 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.784 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.9 mp0 -47.25 -53.24 13.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.673 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.522 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -60.03 -43.0 95.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.186 -179.243 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.5 OUTLIER -53.29 -36.57 61.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.571 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.01 -42.43 32.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.255 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.881 179.088 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.55 HD22 ' HB1' ' A' ' 127' ' ' ALA . 1.2 mt -78.39 -27.52 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.984 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -69.19 -51.85 33.8 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.854 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.21 -30.04 67.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.393 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.57 -49.52 72.84 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.823 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.444 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 6.4 t-160 -76.25 -36.32 58.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.053 0.454 . . . . 0.0 110.273 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -61.02 -52.72 63.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.533 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.94 -50.56 72.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.016 0.436 . . . . 0.0 111.191 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.871 HD23 HD11 ' A' ' 150' ' ' ILE . 94.0 mt -56.88 -31.71 65.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.678 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.16 -4.18 54.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.797 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.1 8.94 20.21 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.795 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.871 HD11 HD23 ' A' ' 147' ' ' LEU . 0.7 OUTLIER -94.67 -136.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.578 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -100.9 -62.62 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.745 0.307 . . . . 0.0 111.446 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -82.98 126.8 32.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.694 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.132 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.812 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.732 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.838 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.514 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.838 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 81.7 Cg_endo -72.36 89.52 0.81 Allowed 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 124.389 3.393 . . . . 0.0 109.567 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.746 HD12 ' HB3' ' A' ' 5' ' ' SER . 0.5 OUTLIER -67.28 136.38 54.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.921 0.391 . . . . 0.0 110.748 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.36 56.09 4.4 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.821 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.746 ' HB3' HD12 ' A' ' 3' ' ' LEU . 73.4 p -72.3 155.85 39.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.667 0.27 . . . . 0.0 110.564 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 59.19 159.38 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.685 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.647 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 58.74 164.69 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.037 0.446 . . . . 0.0 111.063 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.988 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.4 139.9 43.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.043 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.796 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -83.92 123.71 30.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.993 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.45 163.52 30.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 6.4 m -157.75 124.04 4.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 111.146 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.581 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.53 170.13 13.27 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.488 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.611 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -123.55 117.91 26.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.854 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.5 mt -86.77 91.74 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.996 HD11 HG23 ' A' ' 64' ' ' THR . 52.7 mt -79.94 146.31 7.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.622 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.665 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 51.4 p90 -151.33 122.27 7.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.439 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.11 112.24 18.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.69 128.52 45.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.548 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -65.0 160.17 21.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.341 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.558 HD12 HG13 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -50.11 -30.97 12.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.762 0.315 . . . . 0.0 111.163 -179.747 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.558 HG13 HD12 ' A' ' 20' ' ' LEU . 1.3 pp -165.64 151.93 8.71 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.673 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.67 159.15 42.85 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.846 2.364 . . . . 0.0 112.119 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.91 -80.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.046 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 24' ' ' VAL . 21.6 t -95.92 -9.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.363 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t70 67.36 33.98 5.04 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.895 0.379 . . . . 0.0 110.236 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -91.47 -71.11 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.469 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -127.06 33.77 4.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.271 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.54 -24.22 7.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.275 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.665 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.9 mt -129.02 140.43 49.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.453 . . . . 0.0 111.99 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -135.24 126.93 29.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.001 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.0 m-85 -89.7 150.46 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.673 HD23 HD12 ' A' ' 15' ' ' ILE . 44.0 tp -85.88 138.53 31.97 Favored 'General case' 0 CA--C 1.523 -0.059 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.866 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.5 mt -139.13 132.77 30.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.566 HD11 ' HG3' ' A' ' 46' ' ' PRO . 17.0 mt -108.92 100.2 9.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.93 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 41.1 tt0 -55.08 133.95 49.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.21 136.93 58.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.922 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.472 ' HA ' ' CB ' ' A' ' 117' ' ' GLN . 23.9 p -70.7 0.65 6.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.631 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -173.22 -165.16 0.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.783 0.325 . . . . 0.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.22 -126.11 7.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.557 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.592 HD11 ' HB3' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -94.36 8.17 5.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.77 42.75 10.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.35 0.595 . . . . 0.0 109.52 -178.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.592 ' HB3' HD11 ' A' ' 40' ' ' ILE . 24.2 p-80 -91.17 142.6 27.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.791 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.563 ' CE2' HD22 ' A' ' 130' ' ' LEU . 5.9 m95 -101.63 128.5 47.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.49 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.438 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.2 OUTLIER -137.51 139.4 27.19 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.265 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 40.7 Cg_exo -56.87 164.34 6.22 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.244 1.962 . . . . 0.0 111.975 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.566 ' HG3' HD11 ' A' ' 34' ' ' LEU . 29.0 Cg_exo -60.34 83.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.528 0.186 0 C-N-CA 122.669 2.246 . . . . 0.0 112.314 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.48 153.09 19.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.038 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.4 -154.83 6.45 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.088 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -125.36 109.33 12.64 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.547 0.213 . . . . 0.0 110.912 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.796 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -83.21 132.59 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.543 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 2.6 tt0 -95.07 152.15 39.3 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.417 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.543 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.9 Cg_endo -49.26 -31.29 21.87 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.945 2.43 . . . . 0.0 112.831 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.535 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -94.97 -10.66 57.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.304 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -88.6 158.71 18.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.512 0.196 . . . . 0.0 110.589 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.852 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.2 t0 -76.78 160.34 29.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.012 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.92 -61.5 1.83 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.221 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.468 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.6 tp -61.39 -42.14 98.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.747 0.308 . . . . 0.0 111.076 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.852 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.26 -46.7 55.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.373 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.609 HG21 ' N ' ' A' ' 50' ' ' VAL . 89.2 m -55.66 -42.32 74.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.33 -32.7 68.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.059 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.922 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -71.19 -52.97 16.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.603 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 mtt180 -58.09 -39.28 78.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.748 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.6 -30.39 71.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.114 0.483 . . . . 0.0 109.945 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.996 HG23 HD11 ' A' ' 15' ' ' ILE . 18.5 m -65.04 -50.94 64.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.64 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.57 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.5 pp0? -76.05 -24.85 55.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.933 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -79.04 -37.56 38.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.902 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -104.27 -8.81 19.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.911 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.42 -3.25 1.73 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.79 0.24 32.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.619 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.618 HG21 HD23 ' A' ' 75' ' ' LEU . 2.3 mt -103.95 123.99 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.81 167.12 10.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.922 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -48.53 -27.62 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.251 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.29 -21.03 76.44 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.227 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HG2' HG23 ' A' ' 70' ' ' ILE . 1.2 tp60 -98.06 -9.39 26.03 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.793 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -126.03 -171.23 2.34 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.097 0.475 . . . . 0.0 110.514 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 83.9 m -133.85 100.67 4.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.385 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 101' ' ' ALA . 8.1 mm -74.14 118.38 19.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.517 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.74 132.83 30.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -91.04 148.57 22.3 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.122 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.1 -26.8 19.44 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.588 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.481 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.6 t80 -103.49 124.26 48.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.0 111.038 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 127.93 6.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.196 179.606 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.89 142.68 17.74 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.169 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.946 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.2 pm0 -120.87 141.4 50.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.105 0.479 . . . . 0.0 111.816 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.867 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -101.36 118.73 37.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.078 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -111.42 124.44 52.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.144 0.497 . . . . 0.0 111.038 -179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.571 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 25.6 p90 -167.08 145.86 5.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.823 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.61 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.4 p -85.62 111.86 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.764 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.498 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -75.43 -106.34 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.278 -179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -39.61 93.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.858 0.361 . . . . 0.0 110.555 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.4 t30 178.25 30.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.968 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.776 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -156.45 125.4 3.03 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.826 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.3 116.49 4.64 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 123.206 2.604 . . . . 0.0 112.825 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.988 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -99.95 128.39 46.05 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.699 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.6 m -95.59 104.95 16.89 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 177.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.653 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 36.2 t -104.05 108.43 24.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.966 -178.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.946 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.38 136.62 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.466 ' CZ ' HG11 ' A' ' 96' ' ' VAL . 37.2 m-85 -123.49 129.86 51.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.473 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 3.8 m-90 -115.03 148.88 38.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.026 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.523 HD13 ' HG ' ' A' ' 147' ' ' LEU . 6.6 mt -83.29 127.47 33.68 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.61 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.97 144.6 48.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.627 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.432 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -123.31 116.74 23.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.793 0.33 . . . . 0.0 111.396 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.751 HG12 HD23 ' A' ' 75' ' ' LEU . 4.8 m -76.93 121.04 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 121.447 0.642 . . . . 0.0 110.833 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.407 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.99 -22.24 66.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.522 -179.26 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.784 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 4.6 m-20 -104.94 119.83 39.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.987 0.422 . . . . 0.0 111.712 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -43.88 95.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.168 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -96.22 21.26 9.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.079 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.784 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -42.26 145.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.367 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.707 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -62.03 141.2 58.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.318 0.58 . . . . 0.0 111.3 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.925 HG21 ' CD2' ' A' ' 119' ' ' TYR . 35.4 mm -123.99 100.48 7.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.707 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -99.67 101.61 12.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.416 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.512 HD11 ' HD2' ' A' ' 119' ' ' TYR . 17.3 mt -92.75 163.87 13.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.43 -168.9 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -64.46 -18.53 64.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.347 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.93 -18.25 35.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.688 0.28 . . . . 0.0 111.17 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 36.9 m80 -120.02 136.78 54.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.535 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.472 ' CB ' ' HA ' ' A' ' 37' ' ' SER . 6.6 tp60 -109.74 -19.17 13.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.533 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.52 166.25 16.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.869 0.366 . . . . 0.0 111.198 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.925 ' CD2' HG21 ' A' ' 110' ' ' ILE . 43.0 p90 -139.74 173.59 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.841 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.461 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 26.4 mtt-85 -160.68 158.33 28.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 0.0 111.486 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.462 ' CE2' HD13 ' A' ' 32' ' ' LEU . 86.3 m95 -122.09 107.4 12.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.28 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.67 172.7 12.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.065 0.46 . . . . 0.0 111.833 -178.198 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.0 -151.47 6.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.233 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.9 tp -77.3 -46.05 24.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.574 0.226 . . . . 0.0 111.539 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.7 pt-20 -58.18 -51.43 69.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.496 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -67.55 -54.1 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.069 0.461 . . . . 0.0 110.242 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -49.87 -31.11 11.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 0.0 110.157 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.7 m -83.86 -30.79 26.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.736 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -63.87 -43.4 96.18 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.788 -179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.563 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -77.66 -42.55 34.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.184 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.79 54.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 0.0 110.165 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.67 -33.9 0.09 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.302 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.513 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 53.2 m-85 -59.59 120.54 9.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.676 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.38 -54.71 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.246 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.867 ' HB3' HD13 ' A' ' 85' ' ' LEU . 21.4 mp0 -41.67 -54.74 3.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.143 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.616 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.01 -44.64 95.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.206 -179.203 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.03 -42.58 49.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.384 . . . . 0.0 109.994 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.45 -45.04 73.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.76 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.854 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.16 -42.62 66.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -81.81 -29.2 32.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.319 179.345 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 124' ' ' LEU . 1.7 mm-40 -62.71 -51.62 66.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.904 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.84 -29.24 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.483 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.08 72.3 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.215 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 59.4 t-80 -80.41 -29.48 37.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.63 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -67.01 -52.63 40.18 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.243 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.421 ' CE1' HD11 ' A' ' 150' ' ' ILE . 44.2 t80 -63.3 -49.29 74.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.546 HD23 HD11 ' A' ' 150' ' ' ILE . 78.7 mt -57.26 -32.93 67.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.838 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -70.32 -16.64 63.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.8 0.333 . . . . 0.0 110.946 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.06 -7.98 50.28 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.513 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.546 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -91.07 -139.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -152.07 -53.06 0.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -168.1 -174.94 2.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.828 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.571 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.613 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.613 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 82.6 Cg_endo -72.42 175.52 9.95 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 124.356 3.37 . . . . 0.0 109.607 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.99 110.15 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.69 0.281 . . . . 0.0 110.884 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.16 174.76 21.54 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.558 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m 60.17 106.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.869 0.366 . . . . 0.0 110.911 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.46 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -65.37 130.05 41.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.597 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 70.12 165.2 0.27 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.168 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -106.69 125.83 51.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.539 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' CD2' ' A' ' 49' ' ' HIS . 0.3 OUTLIER -79.09 115.58 18.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.099 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' ' O ' ' A' ' 95' ' ' THR . . . -126.78 160.65 30.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.481 ' SG ' HG11 ' A' ' 50' ' ' VAL . 87.4 m -152.01 123.49 7.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.696 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.615 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -114.69 177.59 17.56 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.016 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.68 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -127.55 117.42 22.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.704 0.288 . . . . 0.0 111.44 -179.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.864 HD11 ' HB1' ' A' ' 139' ' ' ALA . 73.4 mt -83.95 91.37 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 17.3 mt -79.23 145.22 9.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.238 -178.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.609 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.8 p90 -148.37 121.95 9.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.849 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 121' ' ' TRP . 3.9 ttp180 -85.95 112.75 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.001 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -90.65 119.81 31.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.071 0.463 . . . . 0.0 111.439 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.2 160.52 30.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.745 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.7 HD23 HG23 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.54 -82.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.32 -179.688 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.7 HG23 HD23 ' A' ' 20' ' ' LEU . 2.8 pp -123.92 149.67 60.44 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.0 111.59 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -65.28 167.57 16.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.739 2.292 . . . . 0.0 112.322 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -144.39 -75.78 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.001 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.3 m -74.67 -10.79 13.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.482 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.1 t0 69.74 25.47 5.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -109.89 -82.34 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.669 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.417 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 24.0 m120 -87.42 -175.68 5.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.189 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 27' ' ' ASN . . . 178.88 -48.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.768 0.318 . . . . 0.0 111.469 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.609 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.5 mt -112.31 141.8 26.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 0.0 112.02 -179.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -128.18 136.08 50.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.098 179.593 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.564 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 50.5 m-85 -95.66 154.37 17.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.637 HD23 ' CD1' ' A' ' 15' ' ' ILE . 56.2 tp -86.93 134.41 33.51 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.496 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.2 mt -135.94 140.23 43.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 112' ' ' LEU . 43.3 mt -115.64 127.42 55.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.454 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -65.93 157.47 30.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.174 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.443 ' O ' ' OG ' ' A' ' 37' ' ' SER . . . -83.42 -14.63 52.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.721 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 117' ' ' GLN . 19.3 p 80.09 -32.18 0.13 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.852 0.461 . . . . 0.0 111.605 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.81 -166.47 2.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.696 0.284 . . . . 0.0 110.721 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.02 -127.16 40.19 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.436 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 40' ' ' ILE . 11.1 tt -86.67 -5.0 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 120.598 0.237 . . . . 0.0 111.341 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 65.0 33.23 9.86 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.839 0.352 . . . . 0.0 110.65 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -62.79 134.51 56.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.598 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.5 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 41.7 m95 -101.68 129.97 47.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.3 p -149.06 143.97 17.57 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -56.16 159.61 12.25 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.313 2.009 . . . . 0.0 112.034 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.592 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 42.9 Cg_exo -57.83 88.9 0.05 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.684 2.256 . . . . 0.0 112.321 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.1 OUTLIER -104.64 156.21 18.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 111.319 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.45 -152.85 6.74 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.451 ' CD2' ' O ' ' A' ' 9' ' ' ARG . 9.8 t-80 -135.54 106.08 6.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.585 ' N ' HG21 ' A' ' 59' ' ' THR . 1.5 p -78.64 129.45 37.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 121.146 0.498 . . . . 0.0 111.472 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.583 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.2 tt0 -91.21 153.54 44.64 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.148 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.8 Cg_endo -44.0 -38.46 10.35 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.108 2.538 . . . . 0.0 113.004 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.583 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.93 -4.16 63.49 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.982 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -91.32 154.6 19.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.723 0.261 . . . . 0.0 110.856 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 17.3 t70 -73.03 158.45 35.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.995 0.426 . . . . 0.0 110.104 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -74.58 -65.38 0.87 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.809 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.737 HD21 HG21 ' A' ' 77' ' ' ILE . 20.2 tp -59.71 -37.65 79.45 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.704 0.287 . . . . 0.0 110.754 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.1 mt-10 -50.27 -50.03 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.379 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.585 HG21 ' N ' ' A' ' 50' ' ' VAL . 20.7 m -54.7 -42.5 71.55 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -70.52 -32.33 69.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.887 178.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.89 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.0 mt -71.04 -52.31 20.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.312 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -61.77 -42.81 99.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.464 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' ' 66' ' ' GLU . . . -60.36 -33.06 71.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.236 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 97.6 m -63.73 -49.28 73.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.36 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.563 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 12.3 pt20 -80.32 -23.26 40.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.716 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.419 ' HB3' ' HA ' ' A' ' 63' ' ' ALA . 22.5 tp10 -79.0 -31.8 44.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -111.63 -14.6 13.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.625 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -130.69 -5.35 4.1 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.486 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.95 1.83 49.59 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.026 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.772 ' O ' HG22 ' A' ' 64' ' ' THR . 2.9 mt -104.11 125.33 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 CA-C-O 120.918 0.389 . . . . 0.0 110.619 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.1 pt-20 -105.69 168.38 9.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.89 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.47 -36.36 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.762 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.83 -22.44 76.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.99 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.487 ' HB3' HG23 ' A' ' 70' ' ' ILE . 3.4 mm-40 -93.21 -5.08 50.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.607 0.241 . . . . 0.0 111.191 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.864 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.21 -166.16 1.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.784 0.326 . . . . 0.0 110.376 178.764 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 90.3 m -139.33 97.85 3.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.513 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.737 HG21 HD21 ' A' ' 57' ' ' LEU . 11.1 mm -71.42 106.33 2.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.212 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.777 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.37 133.35 32.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.596 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.53 151.14 20.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.251 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -21.51 40.36 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.884 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.481 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 19.9 t80 -105.36 127.78 53.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.791 0.329 . . . . 0.0 111.496 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.425 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 6.7 ttpt -158.52 128.06 5.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.525 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.79 147.68 25.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.722 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.8 OUTLIER -128.27 138.04 52.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.189 0.518 . . . . 0.0 111.951 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.892 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.6 mt -99.45 124.75 44.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.122 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.488 ' ND2' ' OG1' ' A' ' 95' ' ' THR . 4.3 m120 -114.21 124.76 52.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.32 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.571 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 30.1 p90 -167.49 146.87 5.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.097 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.63 HG23 ' CA ' ' A' ' 92' ' ' LYS . 11.0 p -89.55 107.68 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.721 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.802 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -74.91 -101.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.563 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 90' ' ' ARG . 0.1 OUTLIER -60.47 -49.43 77.59 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-O 120.91 0.386 . . . . 0.0 110.579 -179.956 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.07 27.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.187 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.843 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.59 131.43 5.94 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 120.931 0.396 . . . . 0.0 110.635 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.89 ' O ' HD12 ' A' ' 8' ' ' LEU . 57.9 Cg_endo -69.33 120.0 6.9 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.56 2.84 . . . . 0.0 112.869 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.836 ' HG2' HD13 ' A' ' 8' ' ' LEU . 18.3 mtpp -105.05 128.29 53.26 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.098 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.488 ' OG1' ' ND2' ' A' ' 86' ' ' ASN . 41.4 m -95.5 109.12 21.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.5 t -106.82 108.51 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.73 128.27 39.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.595 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.8 m-85 -116.63 131.45 56.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -177.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.542 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.3 m-90 -116.36 155.86 27.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.248 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.777 HD12 HG21 ' A' ' 78' ' ' ILE . 2.6 mt -89.83 124.42 34.65 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.08 137.1 46.26 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.75 0.309 . . . . 0.0 110.812 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CE1' ' A' ' 16' ' ' PHE . 13.8 tt0 -113.4 114.53 26.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.572 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.796 HG12 HD23 ' A' ' 75' ' ' LEU . 8.3 m -72.75 101.22 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 121.427 0.632 . . . . 0.0 110.311 179.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.423 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -56.83 -9.64 0.85 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.417 -178.653 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.854 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 9.8 m-20 -108.41 100.87 10.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.933 0.396 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.27 -38.81 59.29 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.992 0.425 . . . . 0.0 110.574 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.58 26.9 5.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.708 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.854 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.7 p -51.5 144.48 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.293 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -70.71 143.88 51.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.999 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 119' ' ' TYR . 35.9 mm -121.7 98.97 6.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.486 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.04 103.14 15.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.85 -179.307 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.5 mt -91.81 173.18 8.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.03 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.9 p -117.15 -172.22 2.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -66.82 -12.49 59.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.668 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -90.7 -23.37 20.74 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.599 0.237 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 71.0 m-70 -113.93 118.92 35.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.933 0.397 . . . . 0.0 110.878 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 22.4 tp60 -85.35 -22.32 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.382 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.33 -177.14 3.93 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.927 0.394 . . . . 0.0 111.497 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.8 ' CD1' HG21 ' A' ' 110' ' ' ILE . 44.5 p90 -148.96 174.4 12.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.439 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 7.3 mtt180 -157.07 149.54 23.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.267 0.556 . . . . 0.0 111.851 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 94.6 m95 -112.78 106.83 15.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.325 178.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.29 167.61 21.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.1 0.476 . . . . 0.0 111.677 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.8 -165.55 28.94 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.912 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.4 tp -64.54 -43.29 94.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.99 -53.8 54.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.51 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.741 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.48 -48.28 56.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.937 0.399 . . . . 0.0 110.1 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.453 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -52.81 -26.93 15.99 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.444 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.8 OUTLIER -82.97 -38.58 22.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.804 178.571 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.741 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -58.33 -45.2 88.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.844 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.631 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -78.71 -38.42 39.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.289 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.451 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.23 50.19 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.713 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.43 -32.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.479 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 34.3 m-85 -59.9 119.69 8.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.773 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -46.48 -50.16 17.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.569 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.892 ' HB3' HD13 ' A' ' 85' ' ' LEU . 35.6 mp0 -48.25 -54.76 12.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.139 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.622 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.17 -44.0 97.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.752 0.31 . . . . 0.0 110.934 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.444 ' HG2' ' SG ' ' A' ' 128' ' ' CYS . 0.0 OUTLIER -49.12 -39.28 27.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.158 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.7 -47.05 50.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.599 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.864 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.59 -46.72 67.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.322 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.441 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -75.45 -27.62 58.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.115 178.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -65.95 -51.8 55.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.209 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.481 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -73.79 -29.68 62.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.481 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.54 -50.32 66.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.757 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -70.25 -37.61 74.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.097 0.475 . . . . 0.0 110.077 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 45.9 tp60 -59.77 -52.49 65.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.245 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -55.08 -55.41 31.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.926 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.595 HD23 HD11 ' A' ' 150' ' ' ILE . 87.6 mt -58.56 -41.22 85.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.08 -12.96 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.691 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.86 -22.53 17.4 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.595 HD11 HD23 ' A' ' 147' ' ' LEU . 3.7 mt -72.32 -124.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.782 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 71.79 79.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.245 0.545 . . . . 0.0 110.957 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -79.06 -10.95 59.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.099 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.878 -179.899 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.802 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.532 0 N-CA-C 110.287 -1.125 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.28 112.47 3.45 Favored 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 124.36 3.374 . . . . 0.0 109.634 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 113.66 2.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.819 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -151.33 161.04 29.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.563 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.4 p -58.4 169.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.717 0.294 . . . . 0.0 111.082 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.04 122.95 14.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 58.96 167.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.098 0.475 . . . . 0.0 111.258 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -108.66 137.26 46.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.751 179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.486 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -81.84 129.72 34.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.828 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.614 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -142.09 164.07 31.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.258 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 28.1 m -153.49 123.67 7.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.51 173.93 15.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.861 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.723 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.8 OUTLIER -127.89 117.89 22.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.959 0.38 . . . . 0.0 111.336 -179.895 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.898 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.8 mt -84.73 91.7 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.93 HD11 HG23 ' A' ' 64' ' ' THR . 52.4 mt -81.99 145.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.33 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.656 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 42.9 p90 -148.98 121.41 8.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.776 -179.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.407 ' HD3' ' C ' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -84.59 113.81 21.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.03 0.443 . . . . 0.0 110.688 179.501 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -90.42 108.39 19.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.025 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.24 155.71 39.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.372 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.525 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -59.95 -81.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.459 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.815 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.0 pp -108.68 149.11 39.03 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.911 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -74.16 157.77 45.98 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.693 2.262 . . . . 0.0 112.254 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.75 -78.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.678 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.597 ' O ' HG12 ' A' ' 24' ' ' VAL . 16.8 t -101.91 11.48 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.555 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 61.47 47.75 6.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.959 0.409 . . . . 0.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -137.82 119.11 14.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 1.3 m-20 71.45 -69.48 0.18 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.04 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 69.64 -62.66 0.41 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.436 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.656 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.7 mt -87.29 154.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.569 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.3 mt-10 -135.63 125.06 24.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.508 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 52.0 m-85 -91.15 145.28 24.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.55 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.691 HD23 HD12 ' A' ' 15' ' ' ILE . 55.4 tp -85.09 138.93 32.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.05 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 34' ' ' LEU . 3.4 mt -139.11 144.21 38.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 112' ' ' LEU . 24.3 mt -122.69 107.23 11.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.752 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.543 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.3 tt0 -64.45 136.75 57.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.002 0.429 . . . . 0.0 111.314 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.18 150.3 34.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.819 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 p -89.83 19.13 4.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.1 t0 178.64 -163.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.43 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.95 -120.28 8.58 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.891 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.524 HD11 ' HB3' ' A' ' 42' ' ' HIS . 4.0 pt -101.15 9.31 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 64.78 22.72 12.6 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.419 0.628 . . . . 0.0 110.581 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.554 ' HE2' H5'1 ' A' ' 154' ' ' ATP . 15.9 p-80 -65.9 163.27 17.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.225 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.543 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 30.1 m95 -113.15 142.86 45.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.248 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.8 OUTLIER -158.86 138.54 8.56 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 170.41 2.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.547 2.164 . . . . 0.0 112.055 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.572 ' HG3' HD11 ' A' ' 34' ' ' LEU . 31.8 Cg_exo -58.81 99.79 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.58 2.186 . . . . 0.0 112.517 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HD3' HG21 ' A' ' 96' ' ' VAL . 0.2 OUTLIER -94.12 148.94 21.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.611 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.475 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -131.16 178.76 17.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.839 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.553 ' CD2' ' N ' ' A' ' 49' ' ' HIS . 2.5 m-70 -121.17 90.69 3.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.663 0.268 . . . . 0.0 110.728 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.834 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -71.26 132.99 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.007 0.432 . . . . 0.0 111.04 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.534 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.4 tt0 -96.8 151.72 38.01 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.854 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 2.6 Cg_endo -47.84 -30.32 13.06 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.864 2.376 . . . . 0.0 112.704 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.528 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -96.74 -9.7 56.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.525 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -87.65 162.17 17.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.492 0.187 . . . . 0.0 110.632 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.861 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 11.8 t70 -78.45 161.35 27.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.997 0.427 . . . . 0.0 110.346 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.404 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 34.9 m-20 -74.24 -64.7 0.96 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.415 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.569 HD21 HG21 ' A' ' 77' ' ' ILE . 10.6 tp -61.52 -40.14 93.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.226 -179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.861 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.92 -50.08 58.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.61 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.834 HG21 ' N ' ' A' ' 50' ' ' VAL . 99.5 m -55.34 -39.19 69.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.861 0.362 . . . . 0.0 110.144 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.77 -38.86 67.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.685 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.875 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.9 mt -64.48 -52.91 55.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.518 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -43.78 97.42 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.47 -33.7 71.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.019 0.438 . . . . 0.0 110.156 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.93 HG23 HD11 ' A' ' 15' ' ' ILE . 23.8 m -60.53 -51.02 71.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.276 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.533 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 8.2 pt20 -77.76 -25.11 48.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.048 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -76.52 -32.66 58.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.08 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.449 ' O ' HD13 ' A' ' 34' ' ' LEU . 2.9 mt-10 -114.92 -0.18 13.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.868 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.04 -8.54 0.7 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.49 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 74.12 -1.32 49.2 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.183 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.646 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.0 mt -103.06 126.1 57.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 117.034 0.417 . . . . 0.0 111.231 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.3 pt-20 -109.92 169.35 8.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.0 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.875 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.5 -36.81 24.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.356 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.53 -15.63 68.62 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.394 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.437 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 1.5 tp-100 -101.48 -11.85 19.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.638 0.256 . . . . 0.0 111.299 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.18 -171.5 2.43 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 121.021 0.438 . . . . 0.0 110.512 179.261 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.452 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 88.2 m -132.6 99.77 4.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.664 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.569 HG21 HD21 ' A' ' 57' ' ' LEU . 10.0 mm -71.63 120.52 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.191 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.566 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.66 136.51 23.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -94.82 150.62 20.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.227 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.42 -18.5 55.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.867 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.838 ' CD1' HD21 ' A' ' 100' ' ' LEU . 14.3 t80 -109.74 128.06 55.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.874 0.368 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 130.93 7.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -153.57 140.7 19.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.56 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.973 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.2 pm0 -119.46 124.23 46.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.786 0.327 . . . . 0.0 111.08 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.59 HD13 ' CB ' ' A' ' 135' ' ' GLU . 7.3 mt -91.15 125.31 35.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.522 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -118.03 121.42 40.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.487 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.41 ' CD2' ' OE2' ' A' ' 135' ' ' GLU . 22.9 p90 -167.11 142.66 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.81 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.562 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -77.63 112.56 15.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.398 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.676 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -83.53 -98.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.528 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -43.23 98.26 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.915 0.388 . . . . 0.0 110.637 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.08 31.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.789 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -163.42 129.54 2.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.344 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.878 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.9 Cg_endo -66.81 119.41 6.43 Favored 'Trans proline' 0 CA--C 1.514 -0.523 0 C-N-CA 123.328 2.686 . . . . 0.0 112.912 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -103.5 120.75 41.46 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.974 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.9 m -85.59 106.43 16.89 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 t -105.11 108.58 25.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.102 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.973 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.49 129.03 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.519 ' HB3' HG13 ' A' ' 14' ' ' ILE . 44.5 m-85 -117.61 158.34 24.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.431 0.634 . . . . 0.0 112.682 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.47 ' CH2' HG21 ' A' ' 97' ' ' ILE . 8.4 m-90 -143.73 150.61 38.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.889 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -86.22 121.33 28.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -129.81 147.19 51.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.122 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.519 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.9 OUTLIER -121.81 116.17 23.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.205 -179.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 HD23 ' A' ' 75' ' ' LEU . 10.0 m -76.02 116.27 18.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.302 0.572 . . . . 0.0 110.989 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -24.98 63.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.725 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.805 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 22.1 m-20 -99.29 112.76 24.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.142 0.496 . . . . 0.0 111.418 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -57.46 -45.64 84.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.181 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.26 25.19 5.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.861 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.805 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 3.2 p -43.92 145.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.004 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -66.35 142.1 57.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.294 0.568 . . . . 0.0 110.998 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.6 mm -121.75 98.15 5.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.49 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.9 OUTLIER -101.16 101.83 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.999 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 34' ' ' LEU . 12.8 mt -87.9 173.15 9.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.159 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.3 -167.07 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.989 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -68.68 -14.07 62.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.403 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.03 -17.87 31.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.692 0.282 . . . . 0.0 111.427 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.452 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 90.2 m-70 -130.17 129.63 43.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.785 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.87 -21.26 18.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.701 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.78 -177.66 6.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.989 0.424 . . . . 0.0 111.643 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.1 p90 -156.46 169.19 25.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.468 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -160.86 154.64 22.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 111.569 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -111.12 107.44 16.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.632 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -134.12 168.35 19.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.378 -178.553 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.16 -152.53 5.91 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.946 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.435 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.1 tp -77.11 -45.8 25.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.853 0.327 . . . . 0.0 111.334 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -58.04 -48.97 78.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.593 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.797 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.46 -48.98 36.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.881 0.372 . . . . 0.0 110.514 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.452 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.15 -30.11 35.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.326 0.584 . . . . 0.0 109.772 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.65 -32.79 25.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.408 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.797 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.0 -42.13 97.27 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.461 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.611 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -78.28 -41.67 33.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.359 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.7 55.97 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.726 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.406 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.32 -33.14 0.09 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.549 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 21.1 m-85 -57.69 113.36 1.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.59 -41.2 14.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.392 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.59 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.6 mp0 -55.01 -51.53 65.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.185 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -62.85 -44.79 95.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -49.67 -39.51 36.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.965 0.412 . . . . 0.0 109.915 179.231 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.591 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.43 -45.55 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.543 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.898 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.77 -44.32 63.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.173 0.511 . . . . 0.0 110.215 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.04 -28.18 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.224 179.194 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.591 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -66.04 -51.99 53.14 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.81 -29.98 68.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.409 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.21 -57.02 21.26 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.807 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.458 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.7 t-160 -67.87 -33.1 74.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.762 0.315 . . . . 0.0 110.262 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -63.02 -52.55 62.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.455 ' CE1' HD11 ' A' ' 150' ' ' ILE . 46.2 t80 -64.33 -47.68 78.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.458 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.597 HD23 HD11 ' A' ' 150' ' ' ILE . 45.1 mt -57.31 -28.72 63.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.443 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -80.38 -14.16 58.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.931 0.396 . . . . 0.0 110.425 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 69.3 m -92.22 -11.82 34.34 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.283 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.597 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -84.78 -136.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 152' ' ' ALA . 1.1 tt0 -160.71 -71.65 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.75 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 151' ' ' GLU . . . 178.14 90.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.964 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.901 -179.835 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.676 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.531 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -72.4 105.93 1.97 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 124.26 3.307 . . . . 0.0 109.539 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.95 -21.91 14.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.48 -164.06 27.83 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.431 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.44 31.34 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.844 0.355 . . . . 0.0 110.793 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.25 129.94 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.724 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 65.02 166.95 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.315 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.948 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.66 140.18 39.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.453 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.696 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.82 131.69 35.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.132 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.61 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -144.26 165.09 28.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.597 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 18.7 m -155.88 123.59 5.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.183 0.516 . . . . 0.0 111.418 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.55 175.45 16.15 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.586 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.694 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.0 OUTLIER -130.92 117.53 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.153 0.476 . . . . 0.0 111.518 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.97 HD11 ' HB1' ' A' ' 139' ' ' ALA . 44.9 mt -84.33 91.27 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.948 HD11 HG23 ' A' ' 64' ' ' THR . 21.2 mt -79.01 146.11 8.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.856 -1.065 . . . . 0.0 111.686 -177.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.754 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.2 p90 -152.48 122.9 7.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.568 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.77 113.76 19.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.647 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' CB ' ' HG3' ' A' ' 102' ' ' GLU . 22.8 ttm180 -94.12 116.52 28.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.313 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 89.7 m -74.8 159.4 31.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.593 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.801 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -61.81 -82.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.964 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.801 HG13 HD12 ' A' ' 20' ' ' LEU . 1.9 pp -112.69 147.06 36.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.689 0.281 . . . . 0.0 111.158 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 5.4 Cg_exo -79.37 160.67 25.85 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.014 2.476 . . . . 0.0 112.205 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.79 -77.94 0.6 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.152 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.5 t -95.09 -9.49 9.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.166 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.47 31.71 1.3 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.866 0.365 . . . . 0.0 110.713 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -61.59 -85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.992 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 7.6 p30 -118.83 -39.44 2.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.968 0.413 . . . . 0.0 110.206 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 70.37 -56.62 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.724 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.754 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.6 mt -102.47 151.03 6.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.116 0.484 . . . . 0.0 111.943 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 2.3 mt-10 -137.76 129.57 28.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.821 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.603 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.2 m-85 -91.91 148.86 21.89 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 ' CD1' ' A' ' 15' ' ' ILE . 46.4 tp -85.15 137.08 33.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.925 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.6 mt -137.13 138.31 40.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.368 . . . . 0.0 111.057 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 46' ' ' PRO . 11.1 mt -118.21 119.08 33.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.642 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.468 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.7 tt0 -82.48 133.84 35.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.538 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.77 149.42 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.791 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.3 OUTLIER -89.0 14.45 10.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.901 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -170.15 -176.89 2.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.42 . . . . 0.0 111.056 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 67.39 -133.17 30.42 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.569 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.558 ' O ' HG12 ' A' ' 40' ' ' ILE . 10.4 tt -81.65 -0.56 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.681 0.277 . . . . 0.0 111.432 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 59.35 33.38 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.869 0.366 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -60.63 156.0 17.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.974 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.533 ' CG ' ' HB3' ' A' ' 130' ' ' LEU . 78.1 m95 -104.32 131.8 51.25 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.936 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.762 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -158.07 156.31 27.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.959 -179.791 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.8 176.89 9.42 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.378 2.052 . . . . 0.0 111.984 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 34' ' ' LEU . 39.2 Cg_exo -60.58 114.58 2.2 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.542 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -103.61 142.35 34.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.047 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -132.62 172.52 21.23 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.235 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -120.9 95.13 4.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.814 0.34 . . . . 0.0 111.122 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.738 ' N ' HG21 ' A' ' 59' ' ' THR . 1.9 p -70.1 132.25 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.694 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.5 tt0 -96.98 152.4 38.32 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.85 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.1 Cg_endo -45.12 -33.99 8.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.018 2.479 . . . . 0.0 112.866 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.694 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.37 -10.42 59.41 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.594 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -86.45 168.0 14.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.608 0.242 . . . . 0.0 110.795 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.853 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.5 t70 -85.95 161.37 19.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 110.698 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.458 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -73.67 -65.67 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.867 -179.389 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.77 HD21 HG21 ' A' ' 77' ' ' ILE . 22.2 tp -62.28 -38.94 91.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.307 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.88 -50.17 57.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.468 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.738 HG21 ' N ' ' A' ' 50' ' ' VAL . 61.4 m -54.64 -38.98 67.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -74.07 -31.11 62.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.043 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.893 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.5 mt -74.18 -53.04 10.67 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.882 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -60.36 -42.96 96.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.542 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -33.82 71.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 0.0 110.038 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.948 HG23 HD11 ' A' ' 15' ' ' ILE . 32.7 m -62.45 -54.24 43.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.586 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.574 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -71.56 -21.16 61.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.165 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.61 -42.64 24.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.743 0.306 . . . . 0.0 111.017 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -105.49 6.16 32.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.637 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.61 -8.59 0.37 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 70.88 0.92 36.44 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.233 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.574 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -104.23 121.43 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-O 120.968 0.414 . . . . 0.0 110.778 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.3 pm0 -104.89 169.35 8.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.893 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -52.54 -26.78 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 110.705 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.413 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -75.05 -11.1 84.16 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.108 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.428 ' HG2' HG23 ' A' ' 70' ' ' ILE . 70.0 tp60 -110.58 -16.07 13.73 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.455 0.169 . . . . 0.0 111.102 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -119.55 -170.17 1.89 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.935 0.397 . . . . 0.0 110.512 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.514 ' H ' ' H ' ' A' ' 102' ' ' GLU . 60.4 m -136.36 102.13 4.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.172 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.77 HG21 HD21 ' A' ' 57' ' ' LEU . 9.7 mm -74.11 124.31 31.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.286 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.495 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.95 136.04 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.281 0.562 . . . . 0.0 111.273 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -96.31 147.83 23.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.61 -29.59 11.17 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.888 ' CD1' HD21 ' A' ' 100' ' ' LEU . 20.0 t80 -102.95 129.79 49.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.76 0.314 . . . . 0.0 110.886 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.56 129.05 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.413 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -149.15 136.01 19.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.133 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.953 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.0 pm0 -122.31 127.79 50.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.952 0.406 . . . . 0.0 111.24 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.017 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.1 mt -91.84 120.66 32.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.499 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -109.84 124.47 51.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.597 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.581 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 23.5 p90 -166.83 144.3 4.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.814 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.611 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.7 p -85.15 108.88 17.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.909 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.794 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -78.94 -97.93 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.158 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -62.28 -50.09 73.06 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.861 0.363 . . . . 0.0 110.682 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -175.1 29.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.244 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.727 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -161.69 130.45 3.03 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.515 179.47 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.841 ' O ' HD12 ' A' ' 8' ' ' LEU . 51.3 Cg_endo -68.32 117.8 5.2 Favored 'Trans proline' 0 CA--C 1.518 -0.313 0 C-N-CA 123.204 2.603 . . . . 0.0 112.789 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.948 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -100.98 117.35 34.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.86 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 54.7 m -80.75 112.54 18.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 177.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.6 t -110.47 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.656 -178.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.953 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.0 130.24 36.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.57 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.5 m-85 -115.52 128.81 56.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.025 0.441 . . . . 0.0 112.089 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CD2' HD13 ' A' ' 57' ' ' LEU . 4.2 m-90 -116.36 146.82 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.097 178.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.888 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -83.46 113.97 21.14 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.36 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.58 147.01 46.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.916 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.565 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tm-20 -123.0 115.45 21.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.337 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.764 HG12 HD23 ' A' ' 75' ' ' LEU . 10.7 m -73.27 122.99 27.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.243 0.544 . . . . 0.0 110.499 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 2.5 mttt -59.94 -26.31 65.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.847 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.674 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 54.1 t0 -105.81 125.69 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 111.828 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -41.09 99.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.283 0.563 . . . . 0.0 109.645 179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -100.03 24.13 8.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.541 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.674 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 3.5 p -40.93 152.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.215 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.712 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 3.0 pm0 -62.16 139.81 58.45 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.331 0.586 . . . . 0.0 111.161 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.893 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.6 mm -124.52 96.95 4.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.705 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.712 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -101.6 99.67 9.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.436 -178.702 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.679 HD11 ' HD1' ' A' ' 119' ' ' TYR . 12.9 mt -92.82 161.18 14.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.912 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -113.57 -169.24 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.389 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -65.99 -13.96 60.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.225 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -84.97 -18.97 32.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.038 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -134.3 109.65 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.726 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.791 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 6.7 pt20 -88.99 2.13 54.45 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.0 160.61 6.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.062 0.458 . . . . 0.0 111.673 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.893 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.2 p90 -140.13 173.02 11.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.51 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.635 ' NH1' HD21 ' A' ' 130' ' ' LEU . 28.4 mtp180 -157.14 156.31 32.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.217 0.532 . . . . 0.0 111.967 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.456 ' CE2' HD13 ' A' ' 32' ' ' LEU . 92.3 m95 -122.35 107.13 11.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.471 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -139.33 172.15 13.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.064 0.459 . . . . 0.0 111.794 -178.322 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.82 -154.5 7.93 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.956 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.5 tp -76.39 -41.83 46.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.745 0.307 . . . . 0.0 111.291 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.9 pt-20 -61.21 -50.3 73.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.404 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.847 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.29 -42.67 65.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.715 -179.564 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.518 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -59.58 -30.6 68.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.9 m -82.45 -35.75 27.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.847 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -61.37 -43.17 99.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.78 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.635 HD21 ' NH1' ' A' ' 120' ' ' ARG . 1.5 mt -77.6 -44.7 27.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.002 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.99 56.1 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.017 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.91 -34.92 0.17 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.186 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.454 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 9.8 m-85 -53.36 114.87 1.64 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.4 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.36 -50.18 12.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.28 -179.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 1.017 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.7 mp0 -48.14 -53.1 17.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.516 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.762 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.11 -47.25 85.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.324 -179.087 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.5 -40.41 37.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.958 0.409 . . . . 0.0 110.352 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.589 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.91 -47.86 60.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.945 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.97 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.11 -44.31 64.38 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.241 0.543 . . . . 0.0 109.919 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -76.88 -27.3 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.078 179.033 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.589 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.82 -52.41 37.2 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.01 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.74 -28.89 62.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.441 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.493 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.21 -40.77 97.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.65 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 -79.0 -27.39 43.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.033 0.444 . . . . 0.0 110.466 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -73.46 -52.49 13.47 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.269 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -58.97 -52.2 66.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.138 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.689 HD23 HD11 ' A' ' 150' ' ' ILE . 74.5 mt -53.99 -42.81 69.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.449 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -13.03 60.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.478 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.71 -15.82 26.23 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.48 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.689 HD11 HD23 ' A' ' 147' ' ' LEU . 1.2 mt -80.97 -133.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -161.44 -69.65 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 110.623 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -157.7 -14.97 0.08 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.976 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.334 -0.106 0 CA-C-N 116.915 -0.13 . . . . 0.0 110.829 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.794 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.813 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.529 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.813 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 83.0 Cg_endo -72.4 95.69 0.79 Allowed 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 124.307 3.338 . . . . 0.0 109.586 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.07 123.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.02 0.438 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.65 -25.14 1.06 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.427 ' HB3' ' HD2' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -167.78 104.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.816 0.341 . . . . 0.0 110.699 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.59 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.0 OUTLIER -92.7 51.52 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.263 0.554 . . . . 0.0 111.07 -179.586 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 73.56 162.2 0.26 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.877 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.909 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.41 130.14 53.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.651 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.633 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.44 120.79 25.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.446 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.02 170.92 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.411 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.2 m -159.58 123.98 3.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 111.098 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.73 178.97 19.12 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.765 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.78 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.1 mt -133.6 118.02 17.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.969 0.385 . . . . 0.0 111.469 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.029 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.2 mt -87.52 91.64 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.853 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -78.12 146.29 8.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.587 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.66 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 35.9 p90 -150.04 123.24 8.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -81.66 113.07 19.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.32 127.82 35.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.96 0.409 . . . . 0.0 112.046 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -92.99 159.73 15.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.217 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.41 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -68.64 -81.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.663 0.268 . . . . 0.0 110.699 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.644 HD12 ' O ' ' A' ' 21' ' ' ILE . 1.6 pp -107.55 150.34 39.99 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.229 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.87 164.78 33.77 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.814 2.343 . . . . 0.0 112.39 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HE3' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -115.11 -76.56 0.57 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.73 179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 24' ' ' VAL . 11.6 t -86.11 -8.23 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.6 5.14 2.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.153 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -95.2 -70.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.134 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 62.6 m-20 -89.63 -179.24 5.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.995 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 27' ' ' ASN . . . 176.54 -43.86 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.947 0.403 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.66 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -117.2 140.98 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.433 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.3 mp0 -126.91 138.51 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.889 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.545 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 49.8 m-85 -100.59 152.24 20.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.97 0.414 . . . . 0.0 112.05 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 15' ' ' ILE . 53.0 tp -84.02 134.37 34.63 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.774 178.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 43' ' ' TRP . 3.6 mt -132.62 142.41 49.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.863 0.363 . . . . 0.0 110.951 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 112' ' ' LEU . 3.4 mt -123.11 104.92 9.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.891 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.476 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 2.6 tt0 -59.88 133.68 56.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.24 147.41 13.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 88.6 p -80.64 2.69 24.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.738 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -175.09 174.1 2.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 110.942 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 86.19 -131.94 10.83 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.652 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.568 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.3 tt -81.31 1.02 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.783 0.325 . . . . 0.0 111.501 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 64.08 29.11 14.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.898 0.38 . . . . 0.0 110.279 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.423 ' HB3' HG23 ' A' ' 40' ' ' ILE . 5.2 p80 -64.98 146.48 54.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.603 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.744 ' HB3' HD22 ' A' ' 33' ' ' LEU . 63.7 m95 -97.38 130.52 44.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.173 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.786 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -152.62 136.37 10.02 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 18.2 Cg_endo -57.37 179.91 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.866 2.377 . . . . 0.0 112.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.538 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.7 Cg_exo -63.91 117.09 4.11 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.644 2.229 . . . . 0.0 112.543 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.82 128.91 55.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.408 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.472 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -117.36 173.37 14.72 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.351 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -109.99 103.63 12.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.914 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.633 HG13 ' HB3' ' A' ' 9' ' ' ARG . 2.1 p -86.7 121.91 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.919 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.509 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 1.5 tt0 -93.73 154.01 41.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.971 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.509 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 3.4 Cg_exo -42.4 -46.44 7.72 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.745 2.297 . . . . 0.0 112.35 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.458 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.64 -11.46 82.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.107 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -85.29 164.33 18.08 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.855 0.327 . . . . 0.0 110.969 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.851 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 25.1 t70 -85.08 159.24 20.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.208 0.528 . . . . 0.0 110.772 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.412 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 21.3 m-20 -71.42 -66.42 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.618 HD21 HG21 ' A' ' 77' ' ' ILE . 12.1 tp -59.23 -40.44 85.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.279 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.85 -50.54 45.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.856 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.575 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.3 m -55.47 -36.05 66.18 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -75.84 -32.67 59.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.758 178.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.669 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.7 mt -73.37 -53.28 11.13 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.044 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -57.9 -43.66 86.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.147 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.79 -34.66 73.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.582 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.853 HG23 HD11 ' A' ' 15' ' ' ILE . 28.4 m -59.39 -53.63 55.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.521 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 4.9 pt20 -74.12 -21.44 59.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.17 -35.82 41.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 110.968 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.429 ' HB3' HD13 ' A' ' 34' ' ' LEU . 8.1 mt-10 -112.24 6.63 19.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.85 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -151.49 -12.15 0.21 Allowed 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.497 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 77.64 -2.76 62.24 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.29 -0.957 . . . . 0.0 112.784 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.619 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.9 mt -100.38 124.77 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.905 0.384 . . . . 0.0 110.831 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -108.58 167.05 10.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.767 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -45.85 -38.54 7.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.648 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.38 -20.53 73.56 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.241 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.421 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.5 tp60 -96.59 -5.68 38.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.519 0.199 . . . . 0.0 111.021 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.08 -168.81 2.15 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.906 0.384 . . . . 0.0 110.369 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.499 ' H ' ' H ' ' A' ' 102' ' ' GLU . 87.7 m -137.11 100.74 4.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.654 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 57' ' ' LEU . 8.1 mm -72.94 125.27 31.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.962 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.491 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.62 133.38 29.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.292 0.568 . . . . 0.0 111.41 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.16 151.92 20.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.205 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 99.76 -22.24 41.33 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.657 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.879 ' CE1' HD21 ' A' ' 100' ' ' LEU . 14.2 t80 -106.03 131.7 53.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 110.911 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.507 ' HD2' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.25 131.92 8.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.232 0.539 . . . . 0.0 111.109 179.778 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -159.39 139.32 11.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.081 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.906 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -126.39 134.27 51.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.913 0.387 . . . . 0.0 111.359 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.877 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.4 mt -93.18 118.74 31.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.98 125.67 53.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.858 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.609 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 22.2 p90 -166.85 142.67 4.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.844 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.576 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.4 p -81.73 112.34 19.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.019 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.4 -107.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -35.84 78.92 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.928 0.394 . . . . 0.0 110.748 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.93 28.55 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.857 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.741 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.9 tppt? -158.53 125.95 2.69 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.99 0.424 . . . . 0.0 111.321 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.769 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.2 Cg_endo -70.16 116.59 4.67 Favored 'Trans proline' 0 CA--C 1.513 -0.555 0 C-N-CA 123.358 2.706 . . . . 0.0 113.096 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.909 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -99.84 123.17 43.82 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.267 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.3 m -88.6 114.18 24.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.664 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.0 t -112.85 108.19 24.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.901 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.906 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.29 128.6 39.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.602 ' HB3' HG13 ' A' ' 14' ' ' ILE . 20.3 m-85 -117.95 128.58 54.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.241 0.543 . . . . 0.0 112.269 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.507 ' NE1' ' HD2' ' A' ' 82' ' ' LYS . 17.7 m-90 -109.99 167.48 10.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.579 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.879 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -103.03 110.91 23.0 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.537 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -118.23 154.49 32.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.499 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tt0 -130.97 115.24 16.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.726 HG12 HD23 ' A' ' 75' ' ' LEU . 5.3 m -73.97 122.2 26.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 121.345 0.593 . . . . 0.0 111.273 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -24.12 66.25 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.166 -178.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.772 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.5 t0 -104.44 117.9 35.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.081 0.467 . . . . 0.0 112.041 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -57.62 -42.81 84.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.0 25.24 8.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.904 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -44.06 142.54 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.869 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -63.53 142.45 58.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.252 0.549 . . . . 0.0 111.422 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.808 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.5 mm -121.05 97.4 4.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.503 179.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.497 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 8.3 mtp180 -102.17 101.69 12.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.88 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 34' ' ' LEU . 10.1 mt -90.73 178.72 5.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.353 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.66 -158.27 0.85 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.996 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -78.73 -3.45 44.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.4 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.78 -22.47 20.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.657 0.265 . . . . 0.0 111.104 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.37 116.71 17.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.41 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.57 -3.49 58.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.913 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -168.72 164.37 12.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 0.0 111.4 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.808 ' CD1' HG21 ' A' ' 110' ' ' ILE . 41.0 p90 -141.33 168.12 20.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.625 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.435 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 6.1 mtt180 -156.45 159.76 38.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.452 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.1 m95 -124.26 107.64 11.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.638 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -136.33 172.74 12.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.98 0.419 . . . . 0.0 111.342 -178.855 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.56 -153.99 7.29 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.959 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.9 tp -77.21 -42.41 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.649 0.261 . . . . 0.0 111.157 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.5 pt-20 -60.81 -50.08 74.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.316 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.82 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.22 -46.9 54.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.651 -179.401 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.535 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.03 -30.65 48.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.414 0.626 . . . . 0.0 109.636 178.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.5 m -83.71 -34.45 24.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.52 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.82 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.04 -41.44 99.5 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 121.091 0.472 . . . . 0.0 109.938 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.594 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.1 mt -77.89 -45.88 22.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.129 179.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.489 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.0 53.74 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.437 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.18 -31.49 0.05 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.585 -179.571 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.403 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 8.9 m-85 -57.19 115.94 2.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.13 0.49 . . . . 0.0 110.412 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.85 -40.01 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.473 -179.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.877 ' HB3' HD13 ' A' ' 85' ' ' LEU . 41.8 mp0 -58.1 -54.08 50.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.72 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.786 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -63.42 -39.65 95.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.749 0.309 . . . . 0.0 110.489 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.79 -37.95 60.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.19 -46.01 36.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.946 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 1.029 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.25 -45.98 62.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.211 0.529 . . . . 0.0 110.314 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.631 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.52 -29.78 59.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.045 179.012 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.578 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -65.54 -51.33 60.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.792 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.56 -29.67 67.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.61 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.8 -44.94 94.04 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.986 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.431 ' NE2' HD12 ' A' ' 29' ' ' ILE . 10.4 t-80 -78.78 -30.81 45.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -64.76 -52.36 57.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.5 ' CD2' HD11 ' A' ' 150' ' ' ILE . 84.6 t80 -61.56 -53.55 54.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.819 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.636 HD23 HD11 ' A' ' 150' ' ' ILE . 96.7 mt -56.02 -24.79 41.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.574 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.61 -10.93 56.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.532 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.3 t -97.14 -18.49 19.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.871 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.636 HD11 HD23 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -74.03 -129.27 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.023 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -160.14 -64.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.821 0.343 . . . . 0.0 111.018 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -158.28 -41.15 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.22 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.609 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.55 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.652 ' HG2' ' H ' ' A' ' 3' ' ' LEU . 83.3 Cg_endo -72.39 -77.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 124.357 3.371 . . . . 0.0 109.634 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.652 ' H ' ' HG2' ' A' ' 2' ' ' PRO . 5.6 mt -65.83 112.9 3.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.832 0.348 . . . . 0.0 110.863 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -144.41 69.59 0.4 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.573 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.403 ' HB3' ' CD ' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -75.4 129.4 37.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.853 179.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.1 tpt -77.75 131.1 37.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.05 0.452 . . . . 0.0 111.011 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.826 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . -58.77 158.28 8.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.696 0.76 . . . . 0.0 112.124 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.761 ' N ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.29 145.99 42.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.132 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.637 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.3 ttt85 -78.82 118.92 21.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.592 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.919 ' HB2' ' CE ' ' A' ' 94' ' ' LYS . . . -127.3 166.64 17.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.058 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -159.24 123.84 4.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.078 0.466 . . . . 0.0 111.762 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.489 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -120.61 171.92 14.87 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.496 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.773 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -125.36 118.18 25.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 117.07 0.435 . . . . 0.0 111.976 -179.171 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.93 HD11 ' HB1' ' A' ' 139' ' ' ALA . 48.6 mt -86.24 91.74 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.985 HD11 HG23 ' A' ' 64' ' ' THR . 30.3 mt -78.88 142.82 13.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.049 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.0 p90 -145.52 121.33 10.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.329 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.451 ' HG2' ' CD1' ' A' ' 106' ' ' TYR . 20.3 tpt180 -81.0 113.34 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.916 0.389 . . . . 0.0 110.075 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.15 125.26 38.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.666 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.22 157.0 16.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.005 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.644 HD23 HG23 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -60.36 -80.9 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.724 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.644 HG23 HD23 ' A' ' 20' ' ' LEU . 2.3 pp -110.25 152.15 43.03 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.595 0.236 . . . . 0.0 111.13 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.12 156.72 38.12 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.787 2.325 . . . . 0.0 112.371 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 -78.49 0.59 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.546 ' O ' HG12 ' A' ' 24' ' ' VAL . 13.2 t -107.75 9.57 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.448 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 60.15 27.81 17.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.79 0.328 . . . . 0.0 110.817 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -107.34 -33.17 7.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.727 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -166.22 120.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.751 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -106.79 -37.64 6.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.203 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.72 HD12 ' NE2' ' A' ' 144' ' ' HIS . 6.5 mt -115.93 141.61 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.976 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -128.84 141.77 51.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.991 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.7 m-85 -103.52 145.41 30.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.979 0.419 . . . . 0.0 111.843 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.549 HD23 HD12 ' A' ' 15' ' ' ILE . 52.1 tp -78.2 135.41 37.61 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.112 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' HB3' ' A' ' 43' ' ' TRP . 6.2 mt -134.23 145.4 49.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.002 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 112' ' ' LEU . 6.6 mt -123.16 113.46 18.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.088 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.469 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.0 tt0 -76.64 147.69 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.559 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.02 150.37 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.092 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.441 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 90.8 p -82.57 1.63 37.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.497 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -174.88 -166.32 0.23 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.886 0.375 . . . . 0.0 110.997 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.44 -120.62 9.31 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.806 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.492 ' O ' HG12 ' A' ' 40' ' ' ILE . 16.2 tt -94.55 -2.25 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.705 0.288 . . . . 0.0 111.49 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 60.97 33.46 19.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.115 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -68.81 150.35 47.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.631 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 130' ' ' LEU . 65.7 m95 -102.12 135.02 44.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.8 153.38 27.47 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.6 172.88 15.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.73 2.287 . . . . 0.0 112.42 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.6 ' HG3' HD11 ' A' ' 34' ' ' LEU . 15.9 Cg_exo -66.11 86.58 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.617 2.211 . . . . 0.0 112.463 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 3.6 pttt -99.95 146.75 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.935 0.397 . . . . 0.0 110.892 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.28 -173.78 13.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.603 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 m80 -112.95 99.19 7.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.643 0.259 . . . . 0.0 110.72 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.719 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -67.01 130.54 32.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.048 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' N ' ' A' ' 52' ' ' PRO . 2.0 tt0 -96.93 151.11 37.56 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.243 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.462 ' N ' ' HG2' ' A' ' 51' ' ' GLU . 82.2 Cg_exo -39.63 -62.36 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.818 2.345 . . . . 0.0 112.463 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.31 -19.0 63.74 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.535 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -79.96 158.92 26.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.799 0.333 . . . . 0.0 110.657 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.862 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 6.0 t70 -83.33 163.26 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.289 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.506 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -71.86 -64.39 0.94 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.154 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 26.5 tp -62.3 -42.88 99.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.418 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.862 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -49.15 -45.68 44.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.758 0.314 . . . . 0.0 110.497 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.719 HG21 ' N ' ' A' ' 50' ' ' VAL . 84.9 m -55.81 -45.19 78.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.125 0.488 . . . . 0.0 109.889 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.51 -28.87 65.29 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.22 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.976 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.6 mt -72.78 -52.46 14.9 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.056 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -57.17 -46.89 82.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.779 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.03 -33.93 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 0.0 110.224 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.985 HG23 HD11 ' A' ' 15' ' ' ILE . 34.0 m -60.13 -52.31 65.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.506 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.521 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -79.19 -22.89 44.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.305 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -78.72 -36.63 43.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.688 0.28 . . . . 0.0 111.207 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 4.5 mm-40 -103.21 -18.09 15.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.721 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.641 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -125.04 -11.92 7.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.67 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 82.24 -10.78 52.8 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 119.85 -1.167 . . . . 0.0 112.423 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.787 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -96.6 122.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 21.0 pm0 -105.64 171.53 7.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.088 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.976 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.59 -34.79 18.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.459 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -16.09 77.32 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.4 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.543 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.2 mm-40 -100.12 -10.57 21.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.547 0.213 . . . . 0.0 110.88 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.32 -169.4 2.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.85 0.357 . . . . 0.0 110.276 179.286 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.9 m -135.76 100.64 4.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.114 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.668 HD13 ' HB2' ' A' ' 101' ' ' ALA . 11.3 mm -74.13 114.17 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.12 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.553 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -78.19 138.68 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 121.09 0.471 . . . . 0.0 110.826 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -95.54 149.4 21.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.0 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.22 -22.07 33.9 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.247 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.632 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.2 t80 -106.64 127.82 53.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.767 0.317 . . . . 0.0 111.16 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.413 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.94 127.88 6.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 111.73 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -151.74 138.61 18.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.8 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -119.8 123.62 44.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.946 0.403 . . . . 0.0 111.481 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 135' ' ' GLU . 9.0 mt -91.08 116.19 28.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.668 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.9 p30 -117.06 130.54 56.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.125 0.488 . . . . 0.0 110.719 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.567 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 18.4 p90 -166.86 139.24 3.52 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.795 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.819 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 8.7 p -81.1 116.14 24.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.34 0.591 . . . . 0.0 111.259 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.786 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -73.63 -92.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.066 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -46.08 13.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.943 0.402 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -166.7 23.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.545 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.605 ' C ' HG23 ' A' ' 88' ' ' VAL . 0.2 OUTLIER -155.77 125.66 3.26 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.707 179.804 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.826 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 39.6 Cg_endo -68.37 -173.79 0.59 Allowed 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.137 1.892 . . . . 0.0 111.649 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.919 ' CE ' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -160.56 112.53 1.94 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.353 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.494 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 89.3 m -86.89 100.93 12.92 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.706 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 47.9 t -103.51 108.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.742 -178.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.22 123.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.733 ' HB3' HG13 ' A' ' 14' ' ' ILE . 29.8 m-85 -109.79 129.02 55.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.366 0.603 . . . . 0.0 112.579 -177.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.536 ' CD2' HD13 ' A' ' 57' ' ' LEU . 7.0 m-90 -115.16 149.59 37.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.985 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.632 HD21 ' CE1' ' A' ' 81' ' ' PHE . 4.0 mt -82.83 121.88 27.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.668 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.57 135.54 48.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.5 tt0 -113.59 117.48 31.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.71 0.29 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 6.4 m -74.79 112.81 12.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.361 0.601 . . . . 0.0 110.579 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -25.78 42.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.802 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.79 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 64.0 t0 -101.06 116.41 32.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.991 0.424 . . . . 0.0 111.101 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.451 ' CD1' ' HG2' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -61.82 -42.31 98.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.105 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.49 21.37 9.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.874 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.79 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.4 p -44.57 143.05 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.243 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.401 ' HG3' ' HE ' ' A' ' 111' ' ' ARG . 2.6 pm0 -65.26 146.04 55.45 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.406 0.622 . . . . 0.0 111.221 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.787 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.83 98.58 5.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.293 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.67 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 8.9 mtt-85 -96.88 105.78 17.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.426 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.638 HD21 ' CG2' ' A' ' 110' ' ' ILE . 9.0 mt -99.63 120.87 40.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.958 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.28 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.658 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -87.63 19.36 3.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.612 0.244 . . . . 0.0 111.171 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -107.09 -43.73 4.55 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 45.3 m80 -98.24 132.6 43.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.703 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.441 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 5.8 tp-100 -93.03 -22.48 19.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.647 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.92 166.88 23.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 111.7 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.729 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.1 p90 -139.23 174.76 10.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.417 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 120' ' ' ARG . 0.1 OUTLIER -160.01 158.52 30.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.147 0.499 . . . . 0.0 111.624 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.404 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 85.8 m95 -123.0 106.96 11.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.62 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.34 165.27 26.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.83 -151.22 2.54 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.364 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.498 HD21 ' CD ' ' A' ' 141' ' ' GLN . 6.9 tp -76.55 -42.8 41.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.86 0.362 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -61.5 -52.49 64.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.83 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.705 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -68.92 -45.0 71.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.97 0.414 . . . . 0.0 110.615 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.16 66.36 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.266 0.555 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.52 -32.33 25.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.257 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -65.18 -44.49 88.32 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -76.23 -44.81 35.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.753 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.09 55.34 1.79 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.814 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -38.75 -34.2 0.14 Allowed 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.415 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.47 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 14.1 m-85 -55.92 118.18 4.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.678 -179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -45.55 -50.91 12.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.52 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.773 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.0 mp0 -46.6 -54.69 8.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.776 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.413 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -64.21 -45.21 89.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.118 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.22 -41.7 50.33 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.302 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -70.64 -47.93 57.52 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.777 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.93 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.86 -42.75 62.88 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.138 0.494 . . . . 0.0 110.307 179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.47 -31.55 42.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.95 178.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.54 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.52 -51.19 66.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.596 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.556 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -70.97 -27.63 63.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.936 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -59.05 -49.35 79.4 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.256 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.72 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.6 t-160 -74.3 -29.12 61.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.922 0.391 . . . . 0.0 110.624 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -67.41 -52.32 41.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.177 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -62.05 -53.14 59.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.21 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.691 HD23 HD11 ' A' ' 150' ' ' ILE . 76.6 mt -54.67 -28.34 46.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.851 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -10.95 59.71 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.866 0.365 . . . . 0.0 110.808 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.46 -9.75 34.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.801 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.691 HD11 HD23 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -83.86 -135.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.936 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.7 -70.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.926 0.393 . . . . 0.0 110.733 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -175.56 -63.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.115 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.762 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.786 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.914 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.914 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.36 141.56 35.54 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.294 3.33 . . . . 0.0 109.646 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.32 166.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 110.831 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.71 94.23 0.12 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.844 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.9 p -148.66 16.23 0.99 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.758 0.313 . . . . 0.0 111.114 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -87.45 117.27 26.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 110.847 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.612 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 60.13 169.7 0.08 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.701 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.903 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -108.24 128.13 54.45 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.096 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.566 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -79.57 116.59 19.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.658 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.514 ' HB3' ' HD3' ' A' ' 94' ' ' LYS . . . -132.78 168.82 17.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.047 0.451 . . . . 0.0 111.619 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 17.7 m -156.31 123.99 5.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.261 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.516 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.93 176.71 17.75 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.76 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.761 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.2 mt -129.96 120.87 25.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 117.237 0.519 . . . . 0.0 112.322 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.65 HD11 ' CG ' ' A' ' 98' ' ' TYR . 5.7 mm -80.63 91.77 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.928 HD11 HG23 ' A' ' 64' ' ' THR . 75.7 mt -84.88 136.7 22.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.574 -177.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.708 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 45.2 p90 -150.17 131.16 14.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.283 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.66 113.95 24.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 110.334 178.721 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.742 ' NH1' HD11 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -91.48 134.36 34.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.435 -179.685 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.95 159.0 15.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.172 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.65 -83.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.707 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.8 pp -118.06 148.07 42.75 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.634 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 14.7 Cg_exo -68.77 161.27 46.15 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.835 2.357 . . . . 0.0 112.285 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.46 -63.44 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.659 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.455 ' O ' ' CB ' ' A' ' 25' ' ' ASP . 10.8 p -98.93 -23.76 4.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.198 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.455 ' CB ' ' O ' ' A' ' 24' ' ' VAL . 6.0 m-20 89.43 34.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.721 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -119.53 -78.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.344 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -93.43 156.32 16.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.039 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -167.51 -48.33 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.62 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.742 HD11 ' NH1' ' A' ' 18' ' ' ARG . 6.3 mt -109.63 144.14 18.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.477 0.656 . . . . 0.0 112.094 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.627 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.0 mm-40 -124.1 172.67 8.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.589 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 40.4 m-85 -133.46 133.94 42.91 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.688 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD23 ' CD1' ' A' ' 15' ' ' ILE . 29.8 tp -75.38 134.58 40.92 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 6.3 mt -135.06 135.43 41.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.082 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.643 HD11 ' HG3' ' A' ' 46' ' ' PRO . 38.9 mt -112.51 102.3 10.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 5.2 tm0? -61.62 134.35 56.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 111.735 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.0 131.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.821 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.552 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 27.0 t -84.64 9.75 12.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.672 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -157.17 -169.02 2.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.649 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.41 -121.55 10.09 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.658 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.597 HG12 ' ND1' ' A' ' 42' ' ' HIS . 23.0 pt -100.66 9.35 8.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 63.0 50.31 3.19 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -178.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.597 ' ND1' HG12 ' A' ' 40' ' ' ILE . 4.8 p-80 -101.2 150.55 22.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.841 -178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.68 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 32.9 m95 -92.84 139.68 30.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.147 0.499 . . . . 0.0 111.957 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.403 ' HB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -157.9 139.12 9.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.002 179.233 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.446 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.3 Cg_endo -66.85 175.51 5.35 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.232 1.955 . . . . 0.0 112.001 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.643 ' HG3' HD11 ' A' ' 34' ' ' LEU . 32.1 Cg_exo -59.4 113.01 1.42 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.762 2.308 . . . . 0.0 112.55 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -112.5 141.44 46.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.829 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.479 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.51 167.8 21.28 Favored Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.629 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.437 ' CE1' ' HE2' ' A' ' 94' ' ' LYS . 48.8 m-70 -113.86 101.89 9.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.811 0.339 . . . . 0.0 110.706 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.59 ' N ' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -67.77 129.98 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.572 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -90.61 172.11 7.37 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.724 -179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 73.3 Cg_exo -50.03 -63.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.57 2.18 . . . . 0.0 112.733 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.03 10.38 58.14 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.292 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 16.7 tt0 -89.22 161.51 16.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.044 0.422 . . . . 0.0 110.912 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.898 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 8.6 t0 -86.81 162.94 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.763 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.495 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -75.15 -63.23 1.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.842 0.353 . . . . 0.0 111.224 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.703 HD21 HG21 ' A' ' 77' ' ' ILE . 26.8 tp -62.75 -40.89 98.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.36 -47.94 55.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.48 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.59 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.6 m -54.19 -42.61 69.92 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.16 -37.13 75.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.825 178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.879 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.2 mt -64.8 -52.7 55.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.593 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.4 tpt180 -62.87 -40.32 97.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.442 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.479 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -63.17 -32.22 73.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.06 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.928 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -65.1 -49.46 69.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.681 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.52 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -76.92 -22.88 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.877 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -79.29 -33.47 43.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.853 0.359 . . . . 0.0 111.228 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -106.74 -16.63 14.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.664 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.85 -6.81 4.51 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.501 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 75.25 -5.57 33.98 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.77 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 74' ' ' GLN . 2.8 mt -98.97 124.22 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 CA-C-N 117.013 0.407 . . . . 0.0 110.529 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 9.6 pt-20 -110.31 170.65 7.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.106 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.879 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.44 -32.51 3.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.828 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.6 -25.75 74.51 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.088 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.693 ' HB3' HG23 ' A' ' 70' ' ' ILE . 11.2 mm-40 -94.41 1.47 55.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.409 0.147 . . . . 0.0 111.146 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.39 -173.92 3.89 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.924 0.392 . . . . 0.0 110.705 178.57 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.556 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 42.4 m -135.93 98.15 3.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.686 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.737 HD12 HD21 ' A' ' 13' ' ' LEU . 11.5 mm -68.69 107.72 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.453 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.502 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.58 133.09 32.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 121.274 0.559 . . . . 0.0 110.715 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -90.96 150.9 21.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.212 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.19 -25.67 22.83 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.092 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.476 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.7 t80 -102.43 119.96 39.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.8 0.333 . . . . 0.0 111.091 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.524 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -149.75 124.75 9.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.275 0.559 . . . . 0.0 110.86 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -148.79 138.14 21.76 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.7 pm0 -118.25 121.06 39.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.034 0.445 . . . . 0.0 111.047 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.8 HD13 ' CB ' ' A' ' 135' ' ' GLU . 5.5 mt -85.09 123.45 30.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.35 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.416 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.2 m-80 -115.45 120.29 39.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.642 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -167.33 141.18 3.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.818 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.621 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.6 p -81.46 109.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.238 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.529 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -78.53 -100.68 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.039 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -38.58 89.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 173.64 28.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.646 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.846 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -157.02 130.15 4.49 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.495 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.903 ' O ' HD12 ' A' ' 8' ' ' LEU . 41.1 Cg_endo -65.46 120.12 7.26 Favored 'Trans proline' 0 CA--C 1.512 -0.594 0 C-N-CA 123.263 2.642 . . . . 0.0 112.368 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.524 ' HD3' HG22 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -103.74 127.24 51.23 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.859 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 69.5 m -100.12 105.14 16.73 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.682 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 52.8 t -105.48 107.72 23.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.933 -178.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.76 111.47 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CG ' HD11 ' A' ' 14' ' ' ILE . 7.4 m-85 -91.05 166.02 13.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.524 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -157.01 134.07 10.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.421 -179.552 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.526 HD13 ' HG ' ' A' ' 147' ' ' LEU . 1.3 mt -73.41 132.69 43.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.301 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.706 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -139.51 138.61 36.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.146 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.708 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.3 tt0 -108.85 109.52 20.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.895 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.767 HG12 HD23 ' A' ' 75' ' ' LEU . 6.1 m -72.49 149.86 8.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.211 0.529 . . . . 0.0 111.39 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.15 -8.18 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.933 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.469 ' O ' HG12 ' A' ' 108' ' ' VAL . 3.2 t70 -149.47 117.88 6.49 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.165 0.507 . . . . 0.0 112.238 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CA ' ' HG3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -49.68 -39.73 37.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.315 0.579 . . . . 0.0 110.365 178.43 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -101.54 25.0 8.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.877 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 105' ' ' ASP . 3.4 p -43.92 156.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.109 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.657 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 3.1 pm0 -60.94 139.7 57.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.274 0.559 . . . . 0.0 110.917 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.807 HG21 ' CD1' ' A' ' 119' ' ' TYR . 45.8 mm -122.14 99.52 7.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.429 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.501 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 2.4 mtt180 -102.7 96.61 6.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.317 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.728 HD21 ' CG2' ' A' ' 110' ' ' ILE . 5.6 mt -86.86 149.55 24.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.834 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.8 m -88.9 -170.14 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -71.49 -5.59 34.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.603 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.0 -24.3 18.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 110.965 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 14.8 m80 -106.52 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.642 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.552 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 13.4 pt20 -123.72 -20.76 5.38 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -161.87 171.85 17.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.158 0.504 . . . . 0.0 111.857 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.807 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.1 p90 -149.43 177.73 9.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.504 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.4 mtt180 -166.6 162.91 16.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.316 0.579 . . . . 0.0 111.949 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.403 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 80.4 m95 -125.17 106.8 10.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.224 178.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.779 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -134.85 170.46 15.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 0.0 111.819 -178.698 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.31 -152.95 5.41 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.827 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.474 HD21 ' NE2' ' A' ' 141' ' ' GLN . 5.7 tp -77.72 -42.93 32.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.69 0.281 . . . . 0.0 111.59 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.537 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.7 pt-20 -60.69 -49.69 76.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.488 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.779 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -69.58 -52.35 26.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.93 0.395 . . . . 0.0 110.006 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.56 -28.12 8.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.382 0.611 . . . . 0.0 109.68 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.431 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 1.0 OUTLIER -83.05 -38.3 22.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.871 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.608 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -58.34 -47.73 82.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.995 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.63 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -77.16 -40.34 45.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.504 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -76.74 54.62 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.634 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.462 ' OE1' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -39.34 -35.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.822 -179.621 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.509 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 6.5 m-85 -58.43 120.62 9.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -46.77 -48.38 20.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.8 ' CB ' HD13 ' A' ' 85' ' ' LEU . 2.1 mp0 -51.17 -53.37 35.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.486 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.663 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -58.62 -39.52 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.057 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -56.99 -44.94 83.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.935 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -66.52 -46.55 75.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.493 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -52.52 -44.63 65.87 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.939 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.663 HD12 ' O ' ' A' ' 136' ' ' MET . 0.9 OUTLIER -80.9 -26.65 36.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.222 179.171 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.584 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 1.8 mm-40 -68.77 -51.81 37.1 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -74.57 -31.61 62.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.597 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.52 -48.3 60.96 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.165 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.436 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 8.2 t-80 -74.95 -32.25 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.041 0.448 . . . . 0.0 110.579 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 31.9 tp60 -64.85 -52.41 56.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.512 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.448 ' CE1' HD11 ' A' ' 150' ' ' ILE . 32.8 t80 -58.03 -54.16 50.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.262 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.643 HD23 HD11 ' A' ' 150' ' ' ILE . 72.5 mt -58.0 -32.17 67.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.857 -179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -15.99 58.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.787 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -19.35 20.08 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.666 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.643 HD11 HD23 ' A' ' 147' ' ' LEU . 1.8 mt -79.21 -132.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -166.37 -64.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.747 0.308 . . . . 0.0 110.576 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -145.34 -68.95 0.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.797 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.529 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.488 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -72.33 63.88 3.58 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 C-N-CA 124.336 3.357 . . . . 0.0 109.6 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.9 mp 58.2 -176.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -60.94 163.94 18.87 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.367 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.06 -176.07 0.24 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 110.643 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.494 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 4.2 tpt -55.87 178.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.065 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 72.38 168.83 0.32 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.121 0.486 . . . . 0.0 110.735 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -102.71 132.91 48.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.643 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.592 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.65 122.64 28.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.319 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -135.73 165.57 25.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.752 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.676 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 57.8 m -154.41 123.22 6.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.145 0.497 . . . . 0.0 111.236 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.409 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.41 172.41 14.27 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.535 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.834 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -126.65 117.17 22.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.018 0.409 . . . . 0.0 111.249 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.824 HD11 ' HB1' ' A' ' 139' ' ' ALA . 76.1 mt -83.95 90.84 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HG23 ' A' ' 64' ' ' THR . 43.2 mt -80.71 145.45 8.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.77 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 47.6 p90 -149.84 122.14 8.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.302 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.795 ' HD3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -81.54 112.9 19.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.274 179.268 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -91.62 102.77 15.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.796 0.332 . . . . 0.0 111.419 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 93.1 m -85.02 159.19 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.353 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.5 tp -60.56 -81.08 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.868 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.494 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.3 pp -136.97 155.13 76.44 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.695 0.283 . . . . 0.0 111.333 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.1 157.19 30.68 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.482 2.121 . . . . 0.0 111.646 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -121.24 -77.5 0.59 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.496 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 t -134.57 -38.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.747 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -161.37 60.77 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.044 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 -150.1 115.0 5.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.277 0.561 . . . . 0.0 110.947 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -53.15 162.05 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.515 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -59.15 2.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.783 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.7 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.4 mt -107.82 143.12 18.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.254 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 1.4 mt-10 -134.7 124.94 26.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.034 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.7 m-85 -89.66 144.6 25.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.65 HD23 HD12 ' A' ' 15' ' ' ILE . 43.1 tp -86.1 131.13 34.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.777 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.528 HD12 ' CD1' ' A' ' 122' ' ' LEU . 6.6 mt -129.69 140.16 51.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.618 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.7 mt -119.75 103.99 9.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.806 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 49.2 tt0 -57.85 119.79 7.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.409 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.55 140.5 56.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.0 p -90.9 15.9 10.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.344 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -153.14 -167.57 2.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.728 0.299 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.55 -134.93 51.1 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.093 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.659 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -87.7 6.5 3.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 O-C-N 122.664 -0.315 . . . . 0.0 111.282 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 m-70 67.79 33.49 4.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.92 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.659 ' HB3' HD11 ' A' ' 40' ' ' ILE . 0.4 OUTLIER -69.97 172.38 7.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.605 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 48.9 m95 -108.13 110.19 21.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.844 0.355 . . . . 0.0 111.264 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.404 ' HB ' ' CD ' ' A' ' 47' ' ' LYS . 53.7 p -128.93 130.6 23.45 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.102 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.56 179.57 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.47 2.113 . . . . 0.0 112.102 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.638 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.6 Cg_exo -54.23 99.96 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.122 1.881 . . . . 0.0 112.093 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -99.34 140.83 32.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.862 0.363 . . . . 0.0 110.927 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.33 164.55 26.56 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.381 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -102.4 111.67 24.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.628 0.251 . . . . 0.0 110.582 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.592 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -86.45 134.34 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.447 0.641 . . . . 0.0 111.291 -179.681 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.786 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 9.0 tt0 -90.64 150.47 42.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.122 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.14 -23.37 22.22 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.761 2.307 . . . . 0.0 112.972 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.786 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.66 -11.24 38.58 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.509 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -84.66 166.51 17.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.894 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.4 t70 -80.35 159.0 25.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.214 0.531 . . . . 0.0 110.263 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.55 -66.39 0.63 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.734 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.634 HD21 HG21 ' A' ' 77' ' ' ILE . 30.9 tp -63.12 -38.06 89.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.437 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.894 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.84 -50.48 45.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.708 0.289 . . . . 0.0 110.498 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.47 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 53.9 m -54.62 -45.89 73.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 109.938 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.676 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -66.41 -29.21 69.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.184 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.964 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -74.6 -52.3 12.13 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.466 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -43.71 90.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.416 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.05 -32.83 72.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.388 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.862 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -61.55 -52.77 63.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.466 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.455 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.1 tt0 -75.06 -23.0 58.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.4 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -79.49 -40.05 30.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.877 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -104.16 1.41 30.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.095 -178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -147.13 -12.44 0.42 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.598 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 78.87 -7.91 47.41 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.779 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.821 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.8 mt -96.32 122.49 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.529 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 6.0 pt-20 -104.48 167.42 9.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.964 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.23 -35.76 8.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.526 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.08 -23.77 76.04 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.018 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.464 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 3.6 tp60 -94.96 -5.65 44.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.793 0.33 . . . . 0.0 111.198 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.923 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.51 -170.99 2.54 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.443 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.526 ' H ' ' H ' ' A' ' 102' ' ' GLU . 35.7 m -137.75 100.86 4.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.691 HD12 HD21 ' A' ' 13' ' ' LEU . 13.3 mm -73.15 109.76 5.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.188 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.556 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -71.63 136.22 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.962 0.411 . . . . 0.0 110.427 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -93.72 149.74 20.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.511 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.0 -15.96 54.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.528 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.71 ' CD2' HD11 ' A' ' 100' ' ' LEU . 18.9 t80 -104.78 135.62 45.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.76 0.315 . . . . 0.0 111.24 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.608 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.99 138.1 12.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.126 0.488 . . . . 0.0 111.437 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 142.78 5.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.347 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.846 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.5 pm0 -132.51 127.34 34.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.903 0.382 . . . . 0.0 111.176 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.024 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.3 mt -90.55 117.31 29.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.433 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -113.96 126.56 55.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.774 -178.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.632 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 22.3 p90 -167.71 141.58 3.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.01 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.616 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.6 p -84.97 111.88 21.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.136 0.493 . . . . 0.0 110.246 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.668 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -71.26 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.442 -178.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -80.0 -37.69 33.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.825 0.345 . . . . 0.0 110.704 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.67 26.99 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.169 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.689 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.62 122.09 2.66 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-O 120.899 0.381 . . . . 0.0 110.896 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.0 Cg_endo -71.68 118.21 5.53 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.223 2.615 . . . . 0.0 112.945 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.728 ' HD3' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -96.76 124.37 40.72 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.069 -179.27 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.513 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 88.7 m -94.14 110.25 21.98 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.5 t -109.89 107.57 23.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.386 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.846 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.62 128.74 39.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 14' ' ' ILE . 26.2 m-85 -114.07 136.39 52.97 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.608 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.5 m-90 -123.37 146.07 48.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.128 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.71 HD11 ' CD2' ' A' ' 81' ' ' PHE . 3.1 mt -78.63 125.97 30.1 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -132.67 147.71 52.34 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.687 0.28 . . . . 0.0 111.388 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.526 ' H ' ' H ' ' A' ' 76' ' ' THR . 7.5 tt0 -126.37 111.95 15.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.748 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.729 HG12 HD23 ' A' ' 75' ' ' LEU . 6.2 m -72.08 130.16 35.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.294 0.569 . . . . 0.0 110.81 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.55 -23.88 67.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.395 -177.88 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 5.7 t70 -107.13 130.23 54.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.074 0.464 . . . . 0.0 112.205 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.795 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 11.2 t80 -66.67 -37.08 84.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.931 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.61 26.4 10.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.064 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.8 p -43.8 146.86 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.925 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -71.3 142.55 50.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.344 0.592 . . . . 0.0 111.252 -179.166 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.821 ' CD1' HD11 ' A' ' 70' ' ' ILE . 43.0 mm -119.64 98.72 6.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.365 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.598 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 1.3 mtp85 -95.7 102.77 14.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.217 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.714 HD11 ' HD1' ' A' ' 119' ' ' TYR . 11.6 mt -100.24 139.85 35.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.804 179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.9 p -94.89 -154.94 0.44 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.601 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 19.12 1.06 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.521 0.201 . . . . 0.0 111.249 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -35.25 8.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.776 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.451 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 38.0 m80 -117.74 139.78 50.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.968 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -92.92 -16.18 25.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.247 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.42 177.35 3.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 111.332 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.776 ' CD1' HG21 ' A' ' 110' ' ' ILE . 49.5 p90 -148.2 169.71 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.756 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.43 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -159.18 153.48 23.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.159 0.504 . . . . 0.0 111.746 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -114.49 107.08 15.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.507 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.24 167.55 21.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.489 -178.579 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -152.56 3.73 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.636 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.2 tp -76.96 -45.47 27.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.929 0.365 . . . . 0.0 110.967 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.6 pt-20 -56.99 -51.34 69.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.489 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.798 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.74 -46.74 62.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.938 0.399 . . . . 0.0 110.539 -179.58 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.589 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -55.66 -30.62 61.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.262 0.553 . . . . 0.0 109.635 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 3.1 m -84.26 -29.7 26.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.433 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.798 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.18 -42.67 88.56 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.979 0.419 . . . . 0.0 110.719 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -77.57 -45.1 26.34 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.762 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.953 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.6 56.68 2.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.502 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -34.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.152 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.596 ' HE1' HD11 ' A' ' 40' ' ' ILE . 10.0 m-85 -58.82 123.85 17.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.81 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.53 -54.67 7.21 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 1.024 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -44.77 -57.88 3.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.918 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.953 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.26 -36.5 75.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.009 0.433 . . . . 0.0 110.575 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.439 ' HD3' ' O ' ' A' ' 133' ' ' PHE . 0.0 OUTLIER -62.7 -37.88 88.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.923 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.59 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.84 -45.6 67.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.578 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.824 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.23 -44.92 65.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.246 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.589 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -78.25 -29.64 48.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.016 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.59 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -62.28 -51.67 66.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.165 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -70.49 -30.03 66.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.716 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.7 -51.65 43.11 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -77.34 -29.2 53.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.86 0.362 . . . . 0.0 110.659 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.23 -52.51 54.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.008 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.597 ' CE1' HD11 ' A' ' 150' ' ' ILE . 55.3 t80 -60.6 -54.75 41.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.8 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.532 HD23 ' CD1' ' A' ' 150' ' ' ILE . 90.0 mt -54.73 -36.84 65.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.619 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 19.3 t -66.14 -13.16 59.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.063 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.97 -18.64 18.51 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.37 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.597 HD11 ' CE1' ' A' ' 146' ' ' PHE . 1.5 mt -77.66 -130.15 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.516 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -168.95 -57.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.056 0.455 . . . . 0.0 110.435 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -151.89 -34.87 0.13 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.156 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.906 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.883 HN61 ' HG2' ' A' ' 135' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.779 ' O ' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.551 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.751 ' HG3' ' CD2' ' A' ' 49' ' ' HIS . 81.6 Cg_endo -72.42 55.03 2.47 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 124.306 3.337 . . . . 0.0 109.594 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.779 HD23 ' O ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -76.13 121.4 22.78 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.066 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 168.18 143.03 3.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.703 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 m 62.6 -177.5 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.863 0.363 . . . . 0.0 111.309 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.66 131.64 41.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.669 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.66 168.88 0.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.26 0.552 . . . . 0.0 111.072 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.65 139.88 41.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.563 179.704 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.695 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.37 118.18 23.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.982 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -129.81 165.67 21.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.977 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 11.2 m -157.79 123.94 4.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.203 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.619 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.2 172.91 14.62 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.182 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.775 HD12 ' OG1' ' A' ' 64' ' ' THR . 2.1 mt -125.83 117.74 24.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.764 0.316 . . . . 0.0 111.386 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.782 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.9 mt -85.3 91.0 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.835 HD11 HG23 ' A' ' 64' ' ' THR . 64.6 mt -79.13 139.86 17.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.096 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.615 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.4 p90 -144.13 121.16 11.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.41 -178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.866 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -87.34 118.59 26.88 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.69 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.6 ttm-85 -92.3 113.39 25.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.458 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.4 160.15 29.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.4 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.646 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.1 OUTLIER -60.03 -95.64 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.587 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.1 pp -107.72 153.64 41.37 Favored Pre-proline 0 C--N 1.332 -0.159 0 CA-C-O 120.712 0.291 . . . . 0.0 111.079 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -66.73 154.16 75.46 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.607 2.205 . . . . 0.0 112.155 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 -82.71 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.2 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 24' ' ' VAL . 13.4 t -86.92 -7.03 10.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.53 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.1 t70 64.24 47.51 3.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.887 0.375 . . . . 0.0 110.423 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -105.53 -55.19 2.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.281 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -159.09 95.79 1.29 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.581 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.1 76.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.559 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.615 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.5 mt -110.89 143.17 21.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.219 0.533 . . . . 0.0 111.791 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 11.7 mp0 -131.25 138.01 49.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.712 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.613 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.0 m-85 -101.38 152.23 20.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.047 0.451 . . . . 0.0 112.047 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.73 HD23 HD12 ' A' ' 15' ' ' ILE . 45.7 tp -86.72 138.51 31.57 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.96 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.3 mt -137.72 139.69 40.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.889 0.376 . . . . 0.0 111.006 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.811 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.4 mt -119.2 109.3 15.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.127 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.0 tt0 -64.78 140.78 58.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.075 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.11 139.16 58.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.169 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 p -78.71 10.55 3.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.442 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.09 -162.65 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.744 0.307 . . . . 0.0 110.404 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.51 -120.3 9.02 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.753 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.649 HD11 ' HB3' ' A' ' 42' ' ' HIS . 5.2 pt -101.36 8.81 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 61.38 41.35 13.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.388 0.613 . . . . 0.0 109.521 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.649 ' HB3' HD11 ' A' ' 40' ' ' ILE . 9.0 p-80 -88.71 149.82 23.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.101 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' A' ' 35' ' ' GLN . 40.1 m95 -98.63 145.1 27.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.663 -179.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.437 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.1 OUTLIER -161.62 149.61 12.33 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.656 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.538 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 38.4 Cg_endo -65.01 166.69 17.86 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.535 2.157 . . . . 0.0 111.974 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.811 ' HG3' HD11 ' A' ' 34' ' ' LEU . 18.1 Cg_exo -66.51 87.88 0.27 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.64 2.227 . . . . 0.0 112.519 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.619 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.6 pttt -98.81 145.32 27.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.42 -166.04 12.02 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.879 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.751 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -119.51 102.49 8.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.624 0.25 . . . . 0.0 111.021 -179.664 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.742 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -76.74 122.05 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.898 0.38 . . . . 0.0 110.752 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -78.12 172.81 8.85 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.768 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 52.6 Cg_exo -54.62 -56.47 2.43 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.387 2.058 . . . . 0.0 112.305 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.08 14.3 61.01 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.974 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.502 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 71.0 tt0 -94.22 158.96 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.863 0.332 . . . . 0.0 110.661 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.0 t70 -79.37 159.47 27.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.65 -58.87 3.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.347 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.496 ' CD2' HG21 ' A' ' 77' ' ' ILE . 37.1 tp -65.74 -39.79 91.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.84 0.352 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.965 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.45 -49.98 53.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.442 179.717 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.742 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.9 m -54.34 -42.79 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.491 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.97 -30.56 66.86 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.098 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 1.057 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.5 mt -71.16 -52.68 17.87 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.69 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 ttp85 -60.73 -41.32 95.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.478 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.659 ' HB1' ' OE1' ' A' ' 67' ' ' GLU . . . -62.09 -31.83 72.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.116 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.835 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -64.9 -49.9 68.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.432 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.6 pt20 -77.43 -26.27 51.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.74 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -79.34 -35.9 40.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.822 0.344 . . . . 0.0 111.023 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.659 ' OE1' ' HB1' ' A' ' 63' ' ' ALA . 2.3 mp0 -106.75 0.92 24.53 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.733 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.3 -7.12 0.41 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.583 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 73.64 -4.87 26.01 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.056 -1.069 . . . . 0.0 113.121 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.8 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.5 mt -100.09 126.75 53.52 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.08 0 CA-C-N 117.214 0.507 . . . . 0.0 110.503 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.505 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.0 pt-20 -109.02 169.55 8.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.424 . . . . 0.0 111.722 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 1.057 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.86 -35.55 10.54 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.818 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.19 -22.06 78.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.131 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.462 ' HB3' HG22 ' A' ' 70' ' ' ILE . 6.6 tp60 -97.31 0.85 48.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.494 0.187 . . . . 0.0 111.397 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.808 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.28 -176.51 4.74 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.117 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.602 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 65.5 m -132.45 100.48 4.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 111.463 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.655 HD12 HD21 ' A' ' 13' ' ' LEU . 9.7 mm -70.17 119.06 15.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.803 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.51 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.59 134.38 27.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.148 0.499 . . . . 0.0 111.113 -179.602 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -93.79 150.97 19.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.312 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.13 -22.96 37.82 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.332 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.861 ' CE1' HD21 ' A' ' 100' ' ' LEU . 19.0 t80 -105.75 126.04 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.579 0.228 . . . . 0.0 110.847 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.506 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 2.2 ttpt -157.55 126.74 5.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.159 0.504 . . . . 0.0 111.615 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.09 139.43 22.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.845 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -122.29 137.81 54.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.111 0.481 . . . . 0.0 111.55 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.005 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.0 mt -103.75 120.7 41.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.583 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -110.95 127.7 55.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.778 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.577 ' CG ' ' C6 ' ' A' ' 154' ' ' ATP . 26.5 p90 -166.95 141.72 4.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.929 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.0 p -85.35 112.87 22.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.836 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.602 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -77.16 -95.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.525 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.81 -37.32 64.92 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-O 120.841 0.353 . . . . 0.0 110.712 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.0 t-20 178.21 26.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.105 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.712 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.01 124.4 3.4 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.049 179.716 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 67.6 Cg_endo -74.2 118.91 5.57 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 123.145 2.563 . . . . 0.0 112.376 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.4 ttpt -103.59 126.36 50.68 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.616 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.9 m -87.62 107.29 18.54 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 18.4 t -105.52 108.31 24.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.026 -178.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -86.24 129.51 38.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.634 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.8 m-85 -113.63 131.98 55.93 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.506 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.3 m-90 -119.58 140.69 50.16 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.774 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.861 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -77.67 133.11 38.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.645 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -142.03 140.93 32.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.795 0.331 . . . . 0.0 111.541 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 8.4 tt0 -113.15 111.6 22.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.721 HG12 HD23 ' A' ' 75' ' ' LEU . 7.0 m -71.61 151.06 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.339 0.59 . . . . 0.0 111.65 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -75.7 -7.6 54.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.927 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.574 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 9.7 t70 -143.89 115.1 7.95 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-O 121.154 0.502 . . . . 0.0 112.349 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.866 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 0.4 OUTLIER -49.35 -40.21 34.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.694 178.885 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -102.95 24.72 10.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.793 178.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.574 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.3 p -43.52 151.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.667 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 109' ' ' GLU . 2.6 pm0 -61.24 138.78 58.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.346 0.593 . . . . 0.0 110.193 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.816 HG21 ' CG ' ' A' ' 119' ' ' TYR . 33.6 mm -121.87 98.07 5.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.295 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.583 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 21.6 mtp180 -97.1 105.64 17.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.196 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 13.7 mt -92.21 155.49 17.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 111.371 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.07 -168.06 1.54 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.641 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -67.1 -18.5 65.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.442 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -84.3 -14.24 50.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.652 0.263 . . . . 0.0 111.521 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 92.7 m-70 -117.99 164.26 15.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.967 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -138.56 -28.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.715 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.8 158.6 37.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.93 0.395 . . . . 0.0 111.619 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.816 ' CG ' HG21 ' A' ' 110' ' ' ILE . 44.4 p90 -135.81 173.51 11.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.446 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.481 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 13.6 mtt85 -156.64 156.42 33.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.304 0.573 . . . . 0.0 111.671 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -120.49 107.17 12.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.659 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.59 170.51 15.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.998 0.428 . . . . 0.0 111.714 -178.413 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.39 -159.8 20.96 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.147 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.526 HD21 ' CD ' ' A' ' 141' ' ' GLN . 7.4 tp -69.61 -41.32 75.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.709 0.29 . . . . 0.0 111.475 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.0 pt-20 -62.87 -51.06 68.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.587 -179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.673 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.42 -51.2 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.838 0.351 . . . . 0.0 110.494 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -51.1 -31.1 18.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.261 0.553 . . . . 0.0 109.638 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 7.0 m -83.39 -29.11 28.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.295 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.548 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -66.91 -45.18 78.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.548 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -75.23 -43.46 51.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.763 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.69 51.67 1.11 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.911 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -38.42 -33.57 0.1 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.527 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.472 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.6 m-85 -55.79 118.54 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.329 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.72 -50.84 13.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 1.005 ' HB3' HD13 ' A' ' 85' ' ' LEU . 17.3 mp0 -46.94 -51.02 17.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.021 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.625 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -67.4 -39.96 85.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.72 0.295 . . . . 0.0 111.139 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -54.64 -33.98 61.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.092 179.328 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.52 -45.41 21.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.652 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.782 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.98 -48.15 64.51 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.395 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.25 -26.65 59.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.245 179.107 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.43 -51.93 38.34 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.967 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.498 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 5.1 mp0 -69.27 -28.97 66.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.251 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.542 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.83 -43.29 99.41 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.719 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -75.91 -27.75 57.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -70.94 -52.47 19.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.355 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.71 -53.83 53.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 83.4 mt -54.77 -29.4 53.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.594 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -13.42 62.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.729 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.37 -14.79 23.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.488 HG13 ' HA ' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -85.26 -134.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -149.48 -59.03 0.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.898 0.38 . . . . 0.0 110.506 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 56.99 165.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.19 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.907 179.998 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.602 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -72.37 156.3 54.78 Favored 'Trans proline' 0 N--CA 1.447 -1.223 0 C-N-CA 124.307 3.338 . . . . 0.0 109.557 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.46 152.33 21.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.818 0.342 . . . . 0.0 110.94 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.85 39.5 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.518 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 m -153.57 32.17 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.644 0.259 . . . . 0.0 110.998 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 ptm -75.23 164.29 26.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.91 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.64 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 60.19 162.39 0.05 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.827 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -114.14 141.67 47.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.732 -179.765 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.863 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -80.66 126.56 31.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.773 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.925 ' HB2' ' HE2' ' A' ' 94' ' ' LYS . . . -137.72 161.62 36.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -156.44 123.08 5.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.17 0.51 . . . . 0.0 111.288 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.477 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.69 176.99 17.24 Favored Glycine 0 N--CA 1.446 -0.633 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.201 178.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.803 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -130.71 117.64 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.139 0.47 . . . . 0.0 111.177 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 98' ' ' TYR . 39.5 mt -84.13 90.3 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.647 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.946 HD11 HG23 ' A' ' 64' ' ' THR . 83.2 mt -79.93 145.36 9.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.413 -178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 47.9 p90 -152.6 127.72 9.76 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.124 -178.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -96.76 113.69 25.27 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.692 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.583 ' NH2' ' HB2' ' A' ' 152' ' ' ALA . 0.6 OUTLIER -87.04 127.22 35.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.483 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.67 161.2 22.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.452 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -80.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.435 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.418 ' H ' HG13 ' A' ' 21' ' ' ILE . 2.5 pp -119.69 150.38 50.16 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.77 0.319 . . . . 0.0 111.523 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.56 156.28 53.3 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.795 2.33 . . . . 0.0 112.224 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.62 -69.57 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.97 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 24' ' ' VAL . 2.8 m -84.72 -12.83 11.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.393 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 63.11 29.81 16.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.921 0.391 . . . . 0.0 110.672 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -91.27 -71.02 0.65 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.875 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -143.46 102.08 3.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.657 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.09 84.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.408 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.769 HD12 ' NE2' ' A' ' 144' ' ' HIS . 4.0 mt -106.15 150.85 8.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.42 0.628 . . . . 0.0 111.713 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.58 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 37.4 mm-40 -120.72 173.5 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.033 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 21.9 m-85 -141.37 128.75 21.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.598 0.237 . . . . 0.0 111.218 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 HD12 ' A' ' 15' ' ' ILE . 39.6 tp -73.0 140.45 47.34 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.614 HD11 ' HA ' ' A' ' 127' ' ' ALA . 8.0 mt -139.91 145.32 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.972 0.415 . . . . 0.0 111.074 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 112' ' ' LEU . 7.9 mt -123.77 112.22 17.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.238 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt0 -72.09 147.78 46.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.204 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.731 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . . . -51.49 177.54 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.386 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 p -106.45 -18.1 14.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.213 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -170.14 -19.43 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.21 -129.07 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.8 -0.714 . . . . 0.0 113.081 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.572 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.2 tt -80.4 2.52 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.302 . . . . 0.0 111.35 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.731 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 2.5 m-70 62.71 30.46 16.84 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.046 0.45 . . . . 0.0 110.27 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.503 ' HB3' HG23 ' A' ' 40' ' ' ILE . 3.3 p80 -69.06 151.33 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.315 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.597 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.4 m95 -109.63 117.83 34.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.194 0.521 . . . . 0.0 111.499 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 ' SD ' ' A' ' 136' ' ' MET . 70.7 p -140.86 145.3 39.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.195 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LEU . 32.2 Cg_exo -57.7 170.71 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.995 1.797 . . . . 0.0 111.452 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.558 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 53.6 Cg_exo -52.03 95.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.328 2.019 . . . . 0.0 112.541 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER -88.55 130.08 35.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.727 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -143.78 123.72 2.11 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.612 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.688 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 23.2 p-80 -67.31 120.21 13.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.509 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.863 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -83.32 140.09 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.122 0.487 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.708 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 5.6 tt0 -91.76 149.49 39.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.93 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.7 Cg_endo -55.27 -20.82 26.39 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.958 2.438 . . . . 0.0 113.355 -178.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.682 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.56 -11.68 43.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.619 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -90.56 168.56 11.72 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.027 0.442 . . . . 0.0 110.911 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.801 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.1 t70 -81.76 160.79 23.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.463 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -69.21 -66.93 0.52 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.578 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD21 HG21 ' A' ' 77' ' ' ILE . 29.1 tp -62.21 -38.04 87.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.166 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.801 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -51.08 -46.82 61.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.721 -179.705 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.53 HG21 ' CA ' ' A' ' 50' ' ' VAL . 95.9 m -55.83 -46.46 78.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -65.4 -31.77 73.04 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.981 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.775 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.1 mt -72.14 -52.32 17.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.464 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 12.2 ttt-85 -62.41 -36.85 83.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.841 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.06 -31.65 72.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.946 HG23 HD11 ' A' ' 15' ' ' ILE . 24.4 m -62.51 -52.31 63.99 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.526 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -74.43 -24.38 59.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.739 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.6 -36.67 37.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.816 0.341 . . . . 0.0 110.597 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.69 10.58 22.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.683 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -158.53 -4.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.597 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 67.41 2.13 18.77 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.342 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.753 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -104.28 125.75 59.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 117.085 0.442 . . . . 0.0 110.363 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -107.94 170.44 7.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.282 -179.435 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.851 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.69 -31.63 7.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.212 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.38 -26.41 74.21 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.889 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.559 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 1.2 mm-40 -96.25 2.17 52.7 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -140.79 -179.15 5.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.047 0.451 . . . . 0.0 110.465 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.1 m -131.59 100.1 5.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.124 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.719 HD12 HD21 ' A' ' 13' ' ' LEU . 11.1 mm -71.1 112.29 5.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.022 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.572 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.18 134.07 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.026 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -93.16 150.93 20.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.74 39.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.16 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.683 ' CD1' HD21 ' A' ' 100' ' ' LEU . 21.1 t80 -104.41 123.49 47.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 110.607 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.47 128.69 6.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.276 0.56 . . . . 0.0 111.663 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -158.38 142.71 15.87 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.415 179.255 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.836 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -120.07 133.18 55.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.073 0.464 . . . . 0.0 111.93 -179.343 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.949 HD13 ' HB2' ' A' ' 135' ' ' GLU . 13.5 mt -97.53 116.19 29.27 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.731 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.2 p30 -115.53 133.34 56.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 111.506 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.628 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 7.2 p90 -166.74 140.07 3.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.64 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.671 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.9 p -81.26 107.19 13.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.338 0.59 . . . . 0.0 110.361 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.546 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -75.32 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.777 -178.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.0 57.37 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.309 . . . . 0.0 110.992 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 171.84 29.19 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.684 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.796 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.1 tptt -158.84 123.63 2.23 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.269 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.827 ' O ' HD12 ' A' ' 8' ' ' LEU . 33.3 Cg_endo -67.9 121.1 8.1 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.988 2.459 . . . . 0.0 113.245 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.925 ' HE2' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.87 113.62 25.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.806 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.3 m -87.76 105.5 17.43 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.693 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 39.5 t -108.03 108.38 25.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.836 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.13 122.54 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.583 ' HB3' HG13 ' A' ' 14' ' ' ILE . 40.4 m-85 -102.92 147.16 27.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -177.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.553 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.1 m-90 -135.07 138.39 43.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.347 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.683 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -74.55 135.43 42.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.523 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -139.75 139.11 36.4 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 120.777 0.322 . . . . 0.0 111.796 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.644 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 13.3 tt0 -113.09 107.94 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.256 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.67 HG12 HD23 ' A' ' 75' ' ' LEU . 9.0 m -72.1 139.76 19.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 121.329 0.585 . . . . 0.0 111.574 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 2.7 mptp? -69.25 -18.22 63.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.511 -178.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.669 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 18.8 t0 -124.25 127.77 48.18 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.532 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 t80 -60.65 -45.09 95.44 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.984 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -98.02 23.9 7.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.074 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.1 p -42.26 143.75 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.136 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -61.05 142.09 56.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.303 0.573 . . . . 0.0 111.144 -178.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.753 ' CD1' HD11 ' A' ' 70' ' ' ILE . 28.7 mm -124.55 96.46 3.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.093 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.597 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 1.4 mtt180 -98.88 102.53 14.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.666 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.499 HD21 ' CG2' ' A' ' 110' ' ' ILE . 11.0 mt -88.61 -178.59 5.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.6 m -127.45 -168.13 1.84 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.275 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.43 -13.42 62.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.578 0.214 . . . . 0.0 111.578 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.84 -18.88 29.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.35 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.439 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 98.5 m-70 -131.04 123.36 28.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.483 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.95 0.5 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.115 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.16 160.2 6.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.937 0.399 . . . . 0.0 111.612 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.747 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.7 p90 -142.03 174.36 10.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.744 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.404 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 15.4 mtt180 -159.46 159.69 33.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.262 0.553 . . . . 0.0 111.784 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.402 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 83.3 m95 -121.45 107.26 12.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.787 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -141.09 168.33 20.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 111.829 -178.639 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.48 -151.77 4.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.908 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 141' ' ' GLN . 15.5 tp -76.91 -49.06 16.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.778 0.323 . . . . 0.0 111.151 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -52.53 -52.09 56.43 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.614 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.818 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -69.57 -51.25 37.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.079 0.466 . . . . 0.0 110.436 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.614 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.93 -29.28 19.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.032 178.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.7 m -84.36 -33.86 23.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.49 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.818 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.67 -42.9 95.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.954 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -78.15 -44.69 25.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.185 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 137' ' ' LYS . . . -76.78 55.69 1.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.097 0.475 . . . . 0.0 109.934 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.379 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.511 ' CZ ' " O2'" ' A' ' 154' ' ' ATP . 45.8 m-85 -57.98 119.21 6.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.538 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.06 -46.75 33.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.735 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.949 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER -51.18 -51.25 55.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.891 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.477 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.74 -41.34 98.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 110.188 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -55.9 -35.28 66.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.75 178.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.05 -44.65 25.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.171 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.83 -53.28 50.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.363 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -69.91 -27.17 64.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.086 179.033 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.522 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.1 OUTLIER -63.22 -51.95 64.19 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.016 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.64 -27.0 60.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.539 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -53.92 -47.1 67.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.203 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.769 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.9 t-160 -78.81 -34.04 45.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.001 0.429 . . . . 0.0 110.611 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -62.31 -52.3 64.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.247 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.513 ' CD1' HD11 ' A' ' 150' ' ' ILE . 28.7 t80 -60.66 -52.61 64.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.133 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 93.1 mt -55.85 -31.88 63.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.483 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.66 -14.63 60.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.615 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.75 -12.24 27.53 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.515 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.516 HD11 HD23 ' A' ' 147' ' ' LEU . 1.1 mt -82.85 -131.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.93 -64.59 1.26 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.131 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.583 ' HB2' ' NH2' ' A' ' 18' ' ' ARG . . . 64.01 114.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.126 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.81 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.71 HN61 ' CD ' ' A' ' 135' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.924 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.924 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 83.1 Cg_endo -72.32 88.31 0.86 Allowed 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 124.315 3.343 . . . . 0.0 109.614 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mt 59.68 87.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.024 0.44 . . . . 0.0 110.774 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.49 33.96 0.68 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.405 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.41 106.37 2.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.887 0.375 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.445 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 1.2 tmm? -89.22 127.54 35.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 68.42 170.37 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 111.704 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.912 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -105.53 134.24 48.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.367 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.724 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.4 ttm-85 -80.31 118.24 21.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.724 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -134.65 166.88 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.659 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.561 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.7 m -157.04 123.78 5.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.053 0.454 . . . . 0.0 111.103 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.563 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.05 176.44 17.08 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.857 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -131.01 117.72 19.58 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.879 HD11 ' HB1' ' A' ' 139' ' ' ALA . 70.2 mt -82.92 90.88 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.748 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -80.9 145.44 8.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.265 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.728 ' HB2' HG23 ' A' ' 29' ' ' ILE . 50.1 p90 -154.32 122.65 6.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.826 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -75.28 115.67 15.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.948 0.404 . . . . 0.0 110.729 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 -106.68 118.05 35.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.236 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.3 160.04 31.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.373 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tp -55.7 -80.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.658 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.405 ' H ' HG13 ' A' ' 21' ' ' ILE . 1.8 pp -115.34 145.42 34.28 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.82 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 2.7 Cg_exo -75.68 157.67 39.83 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.768 2.312 . . . . 0.0 112.683 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -71.95 0.72 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.431 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 24' ' ' VAL . 11.1 t -104.89 5.71 10.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.862 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 t0 67.99 21.85 8.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.006 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -93.62 -83.56 0.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.868 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -94.92 124.19 38.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.36 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.98 -46.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.31 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.728 HG23 ' HB2' ' A' ' 16' ' ' PHE . 9.1 mt -108.26 138.36 35.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.046 0.451 . . . . 0.0 111.873 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.64 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 60.0 mt-10 -134.19 119.44 18.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.973 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.639 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.9 m-85 -82.66 149.19 27.51 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 15' ' ' ILE . 38.9 tp -88.45 135.49 33.45 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.719 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.51 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.3 mt -135.82 141.54 44.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.808 0.337 . . . . 0.0 110.701 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.687 HD22 HD22 ' A' ' 112' ' ' LEU . 19.4 mt -119.64 112.77 19.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.97 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.464 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 3.8 tt0 -74.35 138.49 43.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.197 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.88 145.67 55.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.139 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.484 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 96.4 p -75.26 1.64 13.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.598 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -170.72 -161.14 0.22 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.665 0.269 . . . . 0.0 111.083 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.01 -128.54 40.06 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.779 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.487 ' O ' HG12 ' A' ' 40' ' ' ILE . 11.2 tt -85.53 -6.93 10.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.764 0.316 . . . . 0.0 111.239 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 65.67 33.6 8.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.868 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -66.27 149.14 50.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.924 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.666 ' CE2' HD22 ' A' ' 130' ' ' LEU . 24.9 m95 -106.03 119.48 39.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.533 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -143.49 141.79 19.77 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.133 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.63 158.44 8.11 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.719 2.28 . . . . 0.0 112.405 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.505 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 44.1 Cg_endo -66.62 101.28 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.723 2.282 . . . . 0.0 112.199 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.553 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.14 153.04 19.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.054 0.454 . . . . 0.0 111.561 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.496 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.13 164.19 22.23 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.273 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.474 ' CE1' ' HB3' ' A' ' 8' ' ' LEU . 1.1 t-80 -96.54 102.85 14.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.645 0.26 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.724 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -71.26 130.72 35.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.08 0.466 . . . . 0.0 111.149 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -89.92 174.69 4.48 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.748 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.533 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 51.3 Cg_exo -56.0 -60.52 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.292 1.995 . . . . 0.0 112.462 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.92 7.28 63.35 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.928 -0.653 . . . . 0.0 113.471 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 41.6 tt0 -88.9 164.88 14.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 110.809 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.856 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -88.39 159.81 17.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.152 0.501 . . . . 0.0 110.631 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.419 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.66 -62.77 1.29 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.87 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.742 HD21 HG21 ' A' ' 77' ' ' ILE . 29.7 tp -64.43 -40.8 96.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.481 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.856 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.03 -46.4 52.92 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 120.589 0.233 . . . . 0.0 110.393 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 44.6 m -55.89 -46.73 78.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -66.79 -27.92 67.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.465 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.3 mt -77.06 -52.13 9.86 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.686 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.62 -36.37 80.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.051 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -67.36 -33.76 75.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.202 0.525 . . . . 0.0 109.649 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.748 HG23 HD11 ' A' ' 15' ' ' ILE . 98.6 m -61.22 -55.79 28.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.588 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -68.21 -20.67 64.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.883 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -79.21 -45.58 19.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.908 0.385 . . . . 0.0 110.876 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 3.2 mp0 -104.96 9.87 34.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.628 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -149.75 -9.36 0.3 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.441 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 69.93 0.94 29.76 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.01 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.634 HD13 HG11 ' A' ' 103' ' ' VAL . 1.3 mt -106.3 130.81 57.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 117.087 0.444 . . . . 0.0 110.913 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -113.24 172.85 6.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.95 -30.01 32.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.869 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.99 -10.84 78.35 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.162 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 8.4 mm100 -112.74 -14.46 13.11 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.1 -178.69 3.93 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.281 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.564 ' H ' ' H ' ' A' ' 102' ' ' GLU . 9.6 m -124.31 101.71 7.32 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.581 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.742 HG21 HD21 ' A' ' 57' ' ' LEU . 11.7 mm -78.0 123.59 35.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.69 179.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.553 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -87.97 136.88 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 0.0 111.372 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -94.54 151.29 19.46 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.939 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.34 -26.7 22.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.9 t80 -98.83 132.62 44.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.542 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -158.26 133.59 8.73 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.187 0.517 . . . . 0.0 111.388 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -160.21 143.13 13.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.739 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.872 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -129.65 128.53 42.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.932 0.396 . . . . 0.0 111.118 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.4 mt -89.99 118.25 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.222 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.422 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 6.0 m-20 -111.07 124.46 52.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.502 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.595 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 16.6 p90 -167.7 141.34 3.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.257 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.589 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.3 p -83.89 111.22 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.369 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.677 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -79.01 -102.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.796 -178.588 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -64.07 -35.65 81.43 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.77 0.319 . . . . 0.0 111.01 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 2.6 p-10 173.19 30.72 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.856 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.847 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.92 126.09 2.63 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.78 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.912 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.3 Cg_endo -72.43 119.28 6.03 Favored 'Trans proline' 0 CA--C 1.512 -0.601 0 C-N-CA 123.136 2.557 . . . . 0.0 112.455 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.538 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -100.49 130.2 46.54 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.528 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.1 m -97.03 101.53 13.12 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.72 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 40.2 t -103.33 108.33 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.784 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.872 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.66 122.74 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.665 ' HB3' HG13 ' A' ' 14' ' ' ILE . 25.3 m-85 -110.66 128.18 55.59 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.184 0.516 . . . . 0.0 112.001 -178.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.618 ' CD2' HD13 ' A' ' 57' ' ' LEU . 10.9 m-90 -108.06 169.31 8.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.766 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.608 HD13 ' HG ' ' A' ' 147' ' ' LEU . 2.2 mt -101.52 109.06 20.8 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.621 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -118.75 151.73 37.48 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.093 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.564 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tm-20 -131.3 115.16 15.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.12 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.636 HG12 HD23 ' A' ' 75' ' ' LEU . 6.0 m -71.97 131.44 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.291 0.567 . . . . 0.0 110.632 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 74' ' ' GLN . 4.7 mttt -67.81 -26.04 65.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.178 -178.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.755 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 58.4 t0 -104.16 125.14 50.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.951 0.405 . . . . 0.0 112.047 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -62.24 -42.84 99.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.892 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.9 23.2 9.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.743 178.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.5 p -43.49 148.08 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.326 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.604 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -62.95 140.98 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.31 0.576 . . . . 0.0 111.745 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 33.0 mm -124.23 96.75 4.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.692 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -99.42 101.43 12.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.855 -178.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.719 HD11 ' HD1' ' A' ' 119' ' ' TYR . 9.2 mt -97.09 125.04 41.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.297 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.6 p -65.25 -164.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.422 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -80.29 13.96 2.16 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.676 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -104.54 -35.4 7.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.015 0.436 . . . . 0.0 110.68 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.528 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 42.0 m80 -107.25 123.32 48.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.608 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.484 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 6.1 tp60 -92.5 -13.41 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.586 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -164.23 167.67 19.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.107 0.48 . . . . 0.0 111.761 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.8 p90 -146.63 168.54 21.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.512 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.433 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 18.8 mtt180 -156.08 156.55 34.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.136 0.493 . . . . 0.0 111.553 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.506 ' CE2' HD13 ' A' ' 32' ' ' LEU . 89.1 m95 -119.66 107.52 13.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.592 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.17 167.73 21.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.856 0.36 . . . . 0.0 111.601 -178.451 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -162.2 11.17 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.702 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 8.3 tp -67.92 -45.58 73.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.809 0.305 . . . . 0.0 111.048 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.4 pt-20 -55.14 -53.39 56.49 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.556 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.721 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -68.81 -51.89 35.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.018 0.437 . . . . 0.0 109.84 179.659 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.25 -27.46 9.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.489 . . . . 0.0 109.782 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 124' ' ' LEU . 0.2 OUTLIER -83.0 -33.25 26.59 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.742 178.428 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.636 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -64.7 -45.83 84.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.788 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.666 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -77.4 -36.98 52.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.199 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.82 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.67 49.66 1.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.648 179.123 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.77 -30.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.066 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.525 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 19.6 m-85 -65.0 127.19 30.59 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.58 -56.59 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.001 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.971 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.77 -50.17 26.43 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.089 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.82 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.36 -36.51 75.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.497 -179.433 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -62.13 -32.61 73.22 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.773 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.09 -46.3 35.54 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.699 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.65 -44.66 66.28 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.052 0.454 . . . . 0.0 110.527 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.72 -24.83 41.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.435 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.563 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.06 -52.11 46.21 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.523 -179.469 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -72.66 -30.85 64.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.44 -47.27 84.59 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.742 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.523 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -75.0 -35.11 62.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.085 0.469 . . . . 0.0 110.17 179.296 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -65.09 -52.94 52.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.686 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -63.89 -53.78 45.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 111.159 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.75 HD23 HD11 ' A' ' 150' ' ' ILE . 94.9 mt -55.86 -28.54 57.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.737 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 41.2 t -73.72 -8.37 55.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.522 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.85 -6.24 21.57 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.75 HD11 HD23 ' A' ' 147' ' ' LEU . 0.0 OUTLIER -95.0 -141.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.462 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 2.6 mm-40 -137.1 -69.1 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.927 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -146.77 -40.52 0.2 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.191 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.677 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.525 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.37 85.64 1.06 Allowed 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.336 3.357 . . . . 0.0 109.586 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.04 130.53 46.83 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 110.958 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 110.88 55.85 0.51 Allowed Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.394 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.6 p -144.97 -100.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.616 0.246 . . . . 0.0 111.046 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.442 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 8.4 ttp -75.15 165.53 25.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 120.86 0.362 . . . . 0.0 110.637 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.62 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 69.16 163.94 0.24 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.833 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -111.88 133.99 53.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.178 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.687 ' HB3' HG13 ' A' ' 50' ' ' VAL . 3.6 ttt-85 -79.53 119.85 23.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.476 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.471 ' HB2' ' CG ' ' A' ' 94' ' ' LYS . . . -132.49 163.46 28.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.109 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 46.1 m -156.24 123.85 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.056 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.64 174.06 15.07 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.75 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.725 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -124.95 118.15 25.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.126 0.463 . . . . 0.0 111.872 -179.229 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.909 HD11 ' HB1' ' A' ' 139' ' ' ALA . 52.3 mt -82.44 91.68 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.952 HD11 HG23 ' A' ' 64' ' ' THR . 25.8 mt -83.75 146.46 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.1 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.657 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.45 122.68 7.16 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.657 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.546 ' CZ ' ' HG3' ' A' ' 30' ' ' GLU . 1.2 ppt_? -83.29 112.86 20.27 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.014 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.471 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 5.3 ttp180 -94.32 114.96 27.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.401 -179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 152.43 18.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.705 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.74 -80.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.42 ' H ' HG13 ' A' ' 21' ' ' ILE . 2.7 pp -113.38 152.32 45.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.761 0.315 . . . . 0.0 111.267 179.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.05 150.53 88.38 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.39 2.06 . . . . 0.0 111.977 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.551 ' HE3' HD22 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -90.46 -72.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 m -133.67 -40.98 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -171.28 43.07 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.951 0.405 . . . . 0.0 111.38 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.551 HD22 ' HE3' ' A' ' 23' ' ' LYS . 11.9 p-10 -124.87 121.45 34.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.966 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -42.36 153.46 0.07 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.557 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.5 76.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.947 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.657 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -116.09 137.28 50.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.178 0.513 . . . . 0.0 111.866 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.606 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -136.12 126.81 27.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.468 179.196 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.5 m-85 -86.75 147.41 25.86 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.5 tp -84.04 133.08 34.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.676 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.7 mt -134.32 137.25 44.07 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.951 0.405 . . . . 0.0 110.815 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' HG3' ' A' ' 46' ' ' PRO . 2.2 mt -120.73 105.09 10.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.634 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 1.7 tt0 -59.49 132.77 55.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.212 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.65 135.54 57.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.42 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.468 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 19.0 p -80.95 10.77 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -164.98 -173.31 2.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.728 0.299 . . . . 0.0 110.438 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.95 -131.9 36.67 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -88.69 6.14 3.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.693 0.282 . . . . 0.0 111.462 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 58.03 44.56 19.28 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.807 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.665 ' HB3' HD11 ' A' ' 40' ' ' ILE . 2.7 p-80 -67.93 174.42 3.74 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.185 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 81.0 m95 -120.2 101.99 8.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.638 179.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.657 HG23 ' CD2' ' A' ' 42' ' ' HIS . 71.5 p -126.37 154.32 74.85 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.563 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.548 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 63.4 Cg_endo -70.27 173.88 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.408 2.072 . . . . 0.0 111.969 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.704 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.9 Cg_exo -63.93 86.93 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.517 2.145 . . . . 0.0 112.082 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.58 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 1.2 pttt -96.21 152.26 18.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 111.054 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.14 -177.87 15.88 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.889 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.469 ' CD2' ' HD2' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -107.0 115.92 31.02 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 110.504 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.687 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -90.42 128.84 42.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 121.241 0.543 . . . . 0.0 111.179 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 3.0 tt0 -92.06 153.51 43.3 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.799 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 5.2 Cg_endo -47.7 -43.21 29.06 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.968 2.445 . . . . 0.0 112.432 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.425 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -80.43 -15.21 78.77 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -83.53 164.42 19.82 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.798 0.332 . . . . 0.0 111.258 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.865 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 12.0 t70 -85.22 161.44 19.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.473 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.549 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 1.7 m-20 -72.64 -64.76 0.89 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.606 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.708 HD21 HG21 ' A' ' 77' ' ' ILE . 28.4 tp -63.43 -41.6 98.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.865 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.1 OUTLIER -49.86 -46.3 51.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.512 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.1 m -55.8 -44.87 78.22 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -68.5 -30.06 68.81 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.927 178.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.7 mt -73.14 -52.42 14.25 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.26 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.1 84.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.327 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.58 -34.04 76.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.261 0.553 . . . . 0.0 109.806 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.952 HG23 HD11 ' A' ' 15' ' ' ILE . 39.6 m -59.12 -52.62 64.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.588 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.8 pt20 -74.59 -23.13 58.7 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.2 -35.45 48.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.899 0.38 . . . . 0.0 110.812 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.494 ' HB3' HD13 ' A' ' 34' ' ' LEU . 5.5 mt-10 -109.8 3.05 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.868 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -150.73 -6.97 0.28 Allowed 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.63 2.38 43.47 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 120.071 -1.061 . . . . 0.0 112.618 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.749 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -105.85 128.16 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-O 120.878 0.371 . . . . 0.0 110.301 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 4.4 pm0 -112.19 172.23 7.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.482 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.823 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.67 -31.97 39.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.999 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.79 -6.42 81.76 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.175 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.63 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -112.88 -14.36 13.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.548 0.213 . . . . 0.0 110.968 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.86 -171.07 2.21 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.6 m -130.91 98.78 4.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.251 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.708 HG21 HD21 ' A' ' 57' ' ' LEU . 12.3 mm -73.22 122.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.037 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.693 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -85.28 135.58 24.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -92.97 151.43 19.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.267 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.71 -23.18 37.09 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.524 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.702 ' CD1' HD21 ' A' ' 100' ' ' LEU . 19.8 t80 -102.13 126.11 49.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.841 0.353 . . . . 0.0 110.917 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.468 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.2 ttpt -158.1 125.18 4.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.191 0.52 . . . . 0.0 111.306 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.9 137.54 23.76 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.612 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.827 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.08 127.5 51.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.991 0.424 . . . . 0.0 111.496 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.976 HD13 ' HB2' ' A' ' 135' ' ' GLU . 6.7 mt -92.73 117.34 29.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.225 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.629 HD21 HG23 ' A' ' 95' ' ' THR . 2.0 m-80 -107.02 123.76 48.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.3 -178.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.645 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 25.5 p90 -166.88 143.48 4.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.16 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.592 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.0 p -84.31 111.42 20.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.541 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.616 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -76.4 -106.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -41.55 88.47 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.927 0.394 . . . . 0.0 110.763 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 177.9 29.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.732 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.791 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -155.48 125.84 3.38 Favored Pre-proline 0 N--CA 1.452 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.562 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.53 119.99 6.77 Favored 'Trans proline' 0 CA--C 1.513 -0.544 0 C-N-CA 123.179 2.586 . . . . 0.0 112.481 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.471 ' CG ' ' HB2' ' A' ' 10' ' ' ALA . 6.0 ttpt -106.89 119.02 38.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.96 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.629 HG23 HD21 ' A' ' 86' ' ' ASN . 47.7 m -82.19 107.74 15.12 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.735 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 46.3 t -104.28 107.97 23.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.914 -178.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.827 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.47 131.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.657 ' HB3' HG13 ' A' ' 14' ' ' ILE . 6.1 m-85 -116.24 136.74 52.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.287 0.565 . . . . 0.0 112.135 -177.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.549 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 8.9 m-90 -125.01 140.91 52.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.238 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -74.76 132.21 41.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.709 -0.396 . . . . 0.0 109.936 179.171 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -141.15 135.75 31.16 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.821 0.343 . . . . 0.0 111.549 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.8 tm-20 -113.55 115.8 28.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.257 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.763 HG12 HD23 ' A' ' 75' ' ' LEU . 16.3 m -71.89 122.25 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-O 121.159 0.504 . . . . 0.0 110.447 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -64.05 -22.34 66.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.661 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.912 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -100.91 111.46 23.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.27 0.557 . . . . 0.0 111.711 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -56.69 -39.14 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.65 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -105.76 28.07 7.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.551 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.912 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.3 p -48.18 149.08 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.699 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.438 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 2.1 pm0 -72.24 144.0 48.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 110.577 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.774 HG21 ' CG ' ' A' ' 119' ' ' TYR . 37.6 mm -121.66 94.59 3.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.659 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.473 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.3 OUTLIER -97.59 98.61 10.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.715 -179.405 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.686 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.0 mt -83.09 174.64 10.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HG2' ' A' ' 115' ' ' GLU . 24.7 p -116.18 -167.72 1.32 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -59.94 -43.48 94.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.997 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.401 ' HG2' ' OG ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -69.37 -4.52 18.68 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.495 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.45 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 27.5 m170 -120.99 144.45 48.5 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 111.314 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.468 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 2.4 pt20 -127.53 -18.12 4.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.628 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.72 154.89 18.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.939 0.399 . . . . 0.0 111.421 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.774 ' CG ' HG21 ' A' ' 110' ' ' ILE . 37.8 p90 -136.65 168.15 20.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.41 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 119' ' ' TYR . 6.7 mtt180 -156.19 159.85 39.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.134 0.492 . . . . 0.0 111.598 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.3 m95 -121.33 109.28 14.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.644 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.32 168.33 19.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.028 0.442 . . . . 0.0 111.623 -178.712 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.56 -153.34 3.28 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.714 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.506 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.1 tp -77.13 -43.15 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.808 0.337 . . . . 0.0 111.063 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -59.19 -48.9 79.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.837 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.67 -41.0 63.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.933 0.397 . . . . 0.0 110.851 -179.376 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.58 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -61.22 -29.56 69.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.263 0.554 . . . . 0.0 109.515 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.3 -33.5 23.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.502 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.823 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.71 -42.73 95.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.636 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.621 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -77.35 -43.12 34.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.71 57.71 2.58 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.73 178.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.5 -36.94 0.18 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.929 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.531 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 6.9 m-85 -54.62 118.98 4.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.766 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.09 -51.95 12.95 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.106 0.479 . . . . 0.0 110.605 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.976 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -50.95 -53.35 33.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.564 179.917 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.761 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.74 -37.17 78.24 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -61.25 -34.95 76.0 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.74 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.65 -46.17 55.33 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.895 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.909 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.74 -45.71 63.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.099 0.475 . . . . 0.0 110.004 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.58 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -76.39 -29.69 57.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 178.92 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.567 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -66.22 -52.45 47.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.171 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -69.35 -30.63 68.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.252 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.441 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.16 -44.67 88.74 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.657 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 3.5 t-80 -78.19 -34.23 49.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.748 0.309 . . . . 0.0 110.351 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -61.82 -52.77 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.482 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.64 -50.43 69.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.105 0.479 . . . . 0.0 110.694 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.635 HD23 HD11 ' A' ' 150' ' ' ILE . 96.4 mt -57.21 -34.65 68.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.791 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -73.5 -17.48 61.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.697 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.34 -10.41 35.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.718 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.635 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -84.09 -130.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.95 -52.34 2.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.855 0.359 . . . . 0.0 110.936 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.442 ' HB1' ' NE ' ' A' ' 18' ' ' ARG . . . -54.83 138.09 43.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.642 ' H ' HD22 ' A' ' 153' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.952 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.645 ' C2 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.411 ' HA2' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.549 0 N-CA-C 110.25 -1.14 . . . . 10.92 110.25 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.522 ' HG2' HD22 ' A' ' 3' ' ' LEU . 83.0 Cg_endo -72.41 -177.95 3.03 Favored 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 124.313 3.342 . . . . 8.8900000000000006 109.595 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.522 HD22 ' HG2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER 77.8 -48.63 0.49 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.99 -0.55 . . . . 7.9100000000000001 111.731 179.843 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.87 16.22 77.56 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.856 -0.688 . . . . 4.5199999999999996 112.247 -179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 62.0 m -119.73 18.16 12.67 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.534 0.198 . . . . 3.5299999999999998 111.534 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -52.73 111.66 0.7 Allowed 'General case' 0 C--N 1.345 0.371 0 N-CA-C 109.254 -0.647 . . . . 3.4100000000000001 109.254 179.32 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.745 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 73.3 136.23 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.574 -0.739 . . . . 0.93999999999999995 109.907 -177.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.059 HD13 ' HG2' ' A' ' 94' ' ' LYS . 1.0 OUTLIER -72.26 125.73 28.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.655 -1.157 . . . . 0.95999999999999996 111.618 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.476 ' HB3' HG13 ' A' ' 50' ' ' VAL . 4.9 ttt180 -78.47 111.53 14.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 2.6200000000000001 110.057 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -129.02 168.38 16.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.776 -0.647 . . . . 0.71999999999999997 110.796 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.457 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.1 m -157.11 122.41 4.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.68000000000000005 110.905 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.99 171.98 14.09 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.557 -0.747 . . . . 0.45000000000000001 111.421 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.476 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -126.61 117.11 22.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.987 0.394 . . . . 0.35999999999999999 111.103 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.903 HD11 ' HB1' ' A' ' 139' ' ' ALA . 84.3 mt -82.79 91.2 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.091 -1.077 . . . . 0.56000000000000005 108.091 177.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.868 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -78.44 145.39 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 114.913 -1.04 . . . . 0.29999999999999999 111.087 -178.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.5 p90 -149.12 121.38 8.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 123.431 0.457 . . . . 1.26 111.49 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.94 111.64 17.59 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.791 -0.448 . . . . 4.3200000000000003 109.791 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -98.46 134.25 41.7 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.107 -0.497 . . . . 2.6400000000000001 111.247 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.85 160.13 14.53 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.031 -0.531 . . . . 1.3999999999999999 110.616 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -63.49 1.28 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.403 -0.362 . . . . 2.6899999999999999 110.876 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.499 HD12 ' CE ' ' A' ' 23' ' ' LYS . 1.9 pp -133.19 150.18 74.66 Favored Pre-proline 0 C--O 1.232 0.169 0 CA-C-N 116.286 -0.416 . . . . 2.1099999999999999 111.364 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 20.0 Cg_exo -66.32 151.36 83.52 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.916 2.41 . . . . 2.1499999999999999 112.41 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' CE ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -105.47 -70.19 0.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.139 -0.482 . . . . 3.7999999999999998 110.559 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.9 t -111.41 11.34 8.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.006 -0.543 . . . . 3.3999999999999999 111.322 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.66 38.17 15.45 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.9 0.381 . . . . 5.2999999999999998 111.122 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -100.2 -69.58 0.76 Allowed 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.465 . . . . 4.1299999999999999 111.103 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -139.53 104.5 4.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.008 -0.542 . . . . 2.8799999999999999 111.051 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -86.77 -30.96 21.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.996 -0.547 . . . . 0.72999999999999998 110.971 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.702 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.8 mt -121.4 135.31 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.51000000000000001 111.389 -179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.3 120.93 28.07 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.087 -0.506 . . . . 1.9099999999999999 110.248 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 47.1 m-85 -82.1 149.62 27.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 1.27 112.209 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.633 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 52.4 tp -87.18 134.07 33.57 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.743 -0.662 . . . . 0.27000000000000002 110.032 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.557 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.2 mt -133.69 134.64 43.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.34 -0.391 . . . . 0.34000000000000002 111.085 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 46' ' ' PRO . 20.7 mt -113.0 113.43 25.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.074 -0.512 . . . . 0.45000000000000001 110.803 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -69.62 144.35 53.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.892 -0.594 . . . . 1.6899999999999999 111.606 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.37 139.01 43.78 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.972 -0.558 . . . . 1.1599999999999999 110.362 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.458 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 91.9 p -74.27 -20.58 60.1 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.034 0.383 . . . . 1.47 112.034 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.51 177.74 8.25 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.764 0.316 . . . . 2.8300000000000001 111.452 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.95 -120.54 5.18 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.078 -0.582 . . . . 1.23 112.664 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.431 ' O ' ' CG1' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -98.01 -6.61 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 120.542 0.211 . . . . 1.4399999999999999 110.892 179.59 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 67.97 39.81 2.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.064 0.459 . . . . 1.3500000000000001 110.754 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -72.0 144.52 48.8 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.914 -0.585 . . . . 1.2 110.834 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.557 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 56.8 m95 -95.03 122.59 37.85 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.079 -0.509 . . . . 0.65000000000000002 110.852 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -145.17 144.68 24.25 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.003 -0.544 . . . . 0.66000000000000003 110.9 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.48 171.61 3.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.775 2.316 . . . . 0.75 112.221 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.627 ' HG3' HD11 ' A' ' 34' ' ' LEU . 19.8 Cg_exo -65.04 101.86 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.626 2.217 . . . . 0.60999999999999999 112.264 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.14 142.87 30.07 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.207 -0.452 . . . . 1.8500000000000001 110.97 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -128.55 176.71 18.13 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.104 -0.57 . . . . 0.77000000000000002 112.56 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.1 103.89 12.68 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.726 0.298 . . . . 2.71 110.63 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.602 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -79.31 121.43 32.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 121.113 0.483 . . . . 0.93000000000000005 111.106 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.41 158.38 54.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.5 -0.773 . . . . 1.98 109.978 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.73 -53.59 6.34 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.927 2.418 . . . . 1.3999999999999999 112.453 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.84 -13.24 83.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 121.014 -0.612 . . . . 1.1799999999999999 113.189 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -81.87 155.33 25.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.884 0.342 . . . . 1.4299999999999999 111.114 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 34.9 t70 -79.27 158.3 27.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.244 -0.434 . . . . 1.3300000000000001 110.702 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.465 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -69.3 -62.32 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.852 -0.613 . . . . 1.74 111.598 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.736 HD21 HG21 ' A' ' 77' ' ' ILE . 9.1 tp -62.51 -40.23 96.06 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.789 -0.187 . . . . 0.60999999999999999 111.485 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.84 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -51.6 -40.76 60.43 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.972 0.17 . . . . 1.9099999999999999 110.692 179.657 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.602 HG21 ' N ' ' A' ' 50' ' ' VAL . 96.3 m -61.9 -46.96 87.09 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 110.057 -0.349 . . . . 0.63 110.057 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.24 -43.23 99.31 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 109.63 -0.507 . . . . 0.47999999999999998 109.63 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.85 HD22 ' HB2' ' A' ' 72' ' ' ALA . 97.9 mt -60.39 -52.77 63.81 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.371 -0.831 . . . . 0.5 110.901 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -42.62 85.86 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.868 -0.606 . . . . 2.79 110.809 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.44 -35.64 79.89 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.29 -0.413 . . . . 0.44 111.098 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.868 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -63.99 -43.28 96.17 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.192 -0.458 . . . . 0.34000000000000002 111.208 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.584 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 3.9 pt20 -80.08 -24.64 40.48 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.536 0.199 . . . . 1.71 111.536 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -79.93 -46.05 17.43 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.695 -0.23 . . . . 1.77 111.465 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 21.9 mt-10 -97.81 -11.45 23.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.679 0.622 . . . . 2.0 112.679 -179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -131.96 -3.46 3.6 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.83 0.678 . . . . 0.37 112.83 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 69.65 6.34 54.77 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.391 -0.909 . . . . 0.37 113.546 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.606 ' O ' HG22 ' A' ' 64' ' ' THR . 2.4 mt -111.09 120.12 61.07 Favored 'Isoleucine or valine' 0 C--N 1.341 0.23 0 CA-C-N 117.378 0.589 . . . . 0.34000000000000002 111.346 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.6 pt-20 -97.0 172.27 7.96 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 1.8200000000000001 110.642 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -50.68 -42.01 56.36 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.998 0.37 . . . . 0.45000000000000001 111.998 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.78 -25.7 71.87 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 120.998 -0.62 . . . . 0.47999999999999998 112.742 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.534 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 5.9 tp60 -86.87 2.86 47.72 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 111.773 0.286 . . . . 1.54 111.773 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.841 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -139.48 -164.34 1.66 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.663 0.268 . . . . 0.44 110.5 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.436 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.4 m -143.02 100.85 3.72 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.331 -0.395 . . . . 0.51000000000000001 110.168 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.736 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -75.11 118.06 20.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.99 -0.55 . . . . 0.55000000000000004 111.414 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.596 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -78.7 136.93 22.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.712 -0.677 . . . . 0.56999999999999995 110.682 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.99 146.96 23.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.423 -0.808 . . . . 1.5 111.129 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.98 -28.36 15.61 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.822 -0.704 . . . . 0.75 113.063 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD21 ' A' ' 100' ' ' LEU . 37.9 t80 -98.88 128.91 45.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.3400000000000001 111.633 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -158.25 126.87 5.48 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.707 -0.679 . . . . 1.4099999999999999 110.655 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -152.01 129.57 11.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.586 . . . . 3.0099999999999998 110.75 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.739 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -110.74 137.49 48.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.886 0.374 . . . . 1.4199999999999999 111.248 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.973 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.8 mt -102.2 121.61 42.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.781 -0.645 . . . . 0.68999999999999995 110.553 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.478 HD21 HG23 ' A' ' 95' ' ' THR . 4.7 m-80 -110.27 127.26 54.91 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.301 -0.409 . . . . 1.75 111.773 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.641 ' HB2' ' N1 ' ' A' ' 154' ' ' ATP . 14.5 p90 -167.3 141.6 3.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.788 -0.642 . . . . 1.48 111.428 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.55 ' O ' HG13 ' A' ' 88' ' ' VAL . 9.9 p -82.77 112.6 20.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.49 -0.559 . . . . 0.91000000000000003 109.49 177.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.499 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -72.76 -91.56 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.34 -0.391 . . . . 0.90000000000000002 111.38 -178.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -82.69 -44.76 15.3 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.877 0.37 . . . . 3.5 110.09 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -169.95 31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.869 -0.605 . . . . 2.2799999999999998 111.0 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.989 ' HB3' HD11 ' A' ' 8' ' ' LEU . 8.7 tptt -161.16 126.19 2.17 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.981 0.42 . . . . 2.21 110.904 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.876 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.6 Cg_endo -66.41 121.34 8.59 Favored 'Trans proline' 0 N--CA 1.476 0.457 0 C-N-CA 123.745 2.963 . . . . 0.91000000000000003 112.715 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 1.059 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -101.69 121.33 41.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.002 -0.545 . . . . 1.5800000000000001 111.713 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.478 HG23 HD21 ' A' ' 86' ' ' ASN . 90.1 m -92.76 106.25 18.25 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.93 -0.767 . . . . 0.82999999999999996 108.93 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.0 t -107.01 106.46 20.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 111.735 0.272 . . . . 0.67000000000000004 111.735 -178.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.739 HD13 ' HB3' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -87.0 124.63 40.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.259 -0.645 . . . . 0.75 109.259 178.517 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.512 ' HB3' HG13 ' A' ' 14' ' ' ILE . 45.5 m-85 -109.01 158.04 18.1 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.876 0.695 . . . . 1.28 112.876 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.474 ' CD2' HD13 ' A' ' 57' ' ' LEU . 15.2 m-90 -141.39 157.98 44.47 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 114.762 -1.108 . . . . 0.71999999999999997 109.82 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.596 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 2.0 mt -92.63 108.29 19.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.679 0.276 . . . . 0.54000000000000004 110.261 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.535 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -117.97 125.29 50.11 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.432 -0.349 . . . . 0.34999999999999998 110.645 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CZ ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -104.93 113.89 27.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 1.3799999999999999 111.093 -179.377 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.841 HG12 HD23 ' A' ' 75' ' ' LEU . 10.2 m -72.61 125.63 31.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 121.127 0.489 . . . . 0.53000000000000003 110.404 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.503 ' HE2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -70.37 -16.49 62.98 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.667 -0.697 . . . . 1.4399999999999999 112.646 -178.338 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.753 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 1.1 t70 -105.05 129.85 53.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.757 0.313 . . . . 2.3900000000000001 111.042 179.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.4 -41.04 73.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 2.98 109.932 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.83 32.07 3.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.785 -0.643 . . . . 2.29 110.325 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.6 p -52.14 140.61 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 115.93 -0.577 . . . . 0.58999999999999997 110.33 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -62.0 140.65 58.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.259 0.552 . . . . 1.26 111.693 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.782 HG21 ' CG ' ' A' ' 119' ' ' TYR . 41.4 mm -120.39 98.84 6.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.245 -0.889 . . . . 0.46000000000000002 110.012 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 5.4 mtt180 -101.01 98.48 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.532 -0.758 . . . . 3.2000000000000002 110.844 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.705 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.4 mt -87.67 146.0 25.9 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.589 -0.732 . . . . 0.75 111.73 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.2 m -91.07 -172.35 3.29 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.709 -0.678 . . . . 1.55 110.718 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -60.28 -28.77 68.35 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.718 -0.219 . . . . 2.7599999999999998 111.531 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.75 -44.52 73.58 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 111.798 0.295 . . . . 2.6299999999999999 111.798 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -104.34 123.75 47.96 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 1.3200000000000001 111.498 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 4.0 pt20 -95.42 -26.34 15.9 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.076 -0.511 . . . . 2.6800000000000002 111.814 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -141.61 168.12 20.52 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.03 0.443 . . . . 0.64000000000000001 111.654 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.782 ' CG ' HG21 ' A' ' 110' ' ' ILE . 31.5 p90 -148.24 161.78 40.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.71 -0.677 . . . . 1.3300000000000001 110.635 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -153.78 153.97 33.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.139 0.495 . . . . 2.0499999999999998 111.655 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.561 ' CE2' HD13 ' A' ' 32' ' ' LEU . 82.9 m95 -117.28 106.94 13.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.256 -0.884 . . . . 0.46000000000000002 109.049 178.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.42 168.77 18.59 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.938 0.399 . . . . 0.45000000000000001 111.829 -178.117 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.48 -158.13 6.95 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.835 -0.621 . . . . 0.42999999999999999 112.209 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.4 tp -72.71 -45.79 56.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.596 0.198 . . . . 0.5 111.17 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.6 pt-20 -58.36 -48.65 79.9 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.128 0.418 . . . . 1.3400000000000001 112.128 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.03 -42.09 60.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.689 -0.232 . . . . 1.28 111.041 -179.465 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.557 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.99 -31.01 69.51 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.844 -0.428 . . . . 0.37 109.844 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.65 -37.56 35.7 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.62 -0.718 . . . . 1.46 110.263 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -59.47 -42.67 92.57 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.402 -0.363 . . . . 1.29 111.042 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.598 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -78.22 -42.51 31.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.348 -0.387 . . . . 0.51000000000000001 110.849 179.174 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.793 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.04 56.41 1.98 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.202 0.525 . . . . 0.5 109.858 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.31 -39.48 0.28 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.824 -1.08 . . . . 2.5299999999999998 111.951 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.519 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 56.5 m-85 -56.08 120.39 7.41 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.18 -0.464 . . . . 1.51 109.877 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -57.21 4.35 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.931 0.715 . . . . 1.8600000000000001 112.931 -177.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.973 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.58 -47.2 28.61 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.177 0.298 . . . . 1.71 111.391 -179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.793 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.07 -46.75 87.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.196 -0.298 . . . . 0.62 110.196 179.835 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -40.92 72.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.893 -0.594 . . . . 1.4099999999999999 110.078 178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.523 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.8 -41.88 74.47 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-N 115.97 -0.559 . . . . 0.56999999999999995 111.143 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.903 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.51 -46.89 80.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.95 0.405 . . . . 0.48999999999999999 109.967 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.5 mt -71.76 -31.16 66.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.625 -0.716 . . . . 0.40999999999999998 110.042 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.3 OUTLIER -65.89 -51.75 56.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.918 -0.583 . . . . 1.1899999999999999 111.187 179.579 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.56 -31.7 71.11 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.097 -0.501 . . . . 2.2799999999999998 110.928 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -60.2 -46.09 94.87 Favored Glycine 0 C--N 1.338 0.662 0 C-N-CA 120.786 -0.721 . . . . 0.48999999999999999 111.655 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -72.12 -36.09 69.31 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.551 0.215 . . . . 1.3799999999999999 110.537 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -64.7 -52.71 55.72 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.276 -0.42 . . . . 1.47 111.441 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -56.66 -51.38 68.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.084 -0.507 . . . . 1.3600000000000001 111.065 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.671 HD23 HD11 ' A' ' 150' ' ' ILE . 87.5 mt -59.13 -37.26 76.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.112 -0.494 . . . . 0.64000000000000001 111.671 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 2.0 t -70.45 -19.33 62.97 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.615 0.245 . . . . 1.04 110.72 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -12.14 48.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.372 -0.376 . . . . 1.01 111.503 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.671 HD11 HD23 ' A' ' 147' ' ' LEU . 1.7 mt -79.68 -128.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 110.093 -0.336 . . . . 1.1200000000000001 110.093 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -136.2 -61.51 0.7 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 117.934 0.334 . . . . 3.4500000000000002 111.009 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -156.6 -49.88 0.07 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.216 -0.447 . . . . 3.5899999999999999 111.251 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 2.6 mt . . . . . 0 N--CA 1.464 0.258 0 CA-C-N 116.265 -0.425 . . . . 7.0 111.218 179.995 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.641 ' N1 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -72.37 149.82 51.33 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 C-N-CA 124.283 3.322 . . . . 0.0 109.625 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.08 97.48 0.09 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.902 0.382 . . . . 0.0 110.757 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -144.09 -146.47 4.52 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.246 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.0 t -88.07 2.14 52.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.9 ttp 60.82 158.32 0.04 OUTLIER 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 -179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.8 174.52 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 110.707 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.906 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.47 126.17 54.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.517 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.812 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.8 OUTLIER -78.19 123.82 27.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 48' ' ' GLY . . . -142.83 160.03 41.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.122 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.476 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 80.0 m -150.72 123.79 8.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.176 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.578 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -111.74 177.25 18.74 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' A' ' 13' ' ' LEU . 0.4 OUTLIER -130.26 118.18 20.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.589 0.695 . . . . 0.0 112.328 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.724 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.8 mt -82.64 91.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 27.5 mt -81.51 145.9 8.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.339 -178.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.649 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 35.5 p90 -152.94 127.27 9.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.372 -178.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.503 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.08 113.02 23.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.006 0.431 . . . . 0.0 110.119 178.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.12 125.06 34.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.466 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -83.85 154.87 23.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.379 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.7 mt -59.48 -81.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.771 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.555 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.8 pp -109.07 150.37 40.88 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.638 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.48 152.45 81.85 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.677 2.252 . . . . 0.0 112.408 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.41 ' HE3' ' O ' ' A' ' 21' ' ' ILE . 0.1 OUTLIER -122.7 -78.8 0.6 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.778 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.424 ' O ' HG12 ' A' ' 24' ' ' VAL . 20.4 t -86.95 -9.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.699 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 64.76 22.67 12.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.85 0.357 . . . . 0.0 110.811 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -73.99 -78.9 0.09 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.498 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.526 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 0.9 OUTLIER -123.17 -31.75 3.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.851 179.42 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 73.86 -54.61 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.533 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.581 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.8 mt -102.39 149.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.705 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.649 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.8 mp0 -116.7 172.65 7.09 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.036 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 27.9 m-85 -135.14 129.11 33.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.564 0.221 . . . . 0.0 111.14 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -71.95 133.08 45.15 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.593 HD22 ' HB3' ' A' ' 43' ' ' TRP . 4.0 mt -133.99 144.74 48.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.729 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 112' ' ' LEU . 51.7 mt -123.41 109.73 14.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.065 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.488 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -72.62 143.38 48.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.423 -179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.82 176.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.636 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.543 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 21.7 p -103.36 -9.73 19.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.562 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -164.0 -172.96 2.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.777 0.322 . . . . 0.0 110.69 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.38 -123.96 7.02 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.351 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.545 ' O ' HG12 ' A' ' 40' ' ' ILE . 8.9 tt -90.46 -3.65 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.767 0.318 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.97 29.77 16.44 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.78 0.324 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -57.3 151.74 15.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.576 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.682 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.8 m95 -103.91 140.93 37.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.305 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.691 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -163.43 141.8 6.22 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.901 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.5 Cg_endo -66.42 169.11 14.68 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.367 2.044 . . . . 0.0 111.896 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.607 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 51.7 Cg_exo -51.69 103.98 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.594 2.196 . . . . 0.0 112.644 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.61 124.05 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.967 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.26 169.68 13.39 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.322 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -118.25 104.84 11.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.702 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.812 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.56 129.29 37.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.425 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.655 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -91.48 177.36 2.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.408 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.655 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.5 Cg_exo -57.34 -54.2 3.81 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.402 2.068 . . . . 0.0 112.87 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.23 3.73 86.56 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.373 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 21.6 tt0 -84.43 171.24 12.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.901 0.35 . . . . 0.0 110.736 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.884 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.7 t70 -97.06 157.73 15.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.273 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.543 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 12.9 m-20 -70.04 -64.92 0.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.281 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 22.7 tp -62.79 -42.93 99.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.113 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.884 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -49.35 -43.08 43.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.543 -179.794 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 25.9 m -58.56 -45.26 89.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.04 -30.04 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.823 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.756 HD22 ' HB2' ' A' ' 72' ' ' ALA . 88.4 mt -72.93 -51.85 16.91 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.118 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -41.71 95.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.802 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.502 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -61.39 -39.57 91.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.173 0.511 . . . . 0.0 109.826 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -58.18 -47.03 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.891 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.476 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 13.2 pt20 -80.0 -25.15 40.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.978 0.418 . . . . 0.0 110.484 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -30.06 50.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.718 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 69.2 mm-40 -107.68 -27.07 10.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.772 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -121.8 -7.93 8.98 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.895 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 79.49 -8.87 45.33 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 119.712 -1.232 . . . . 0.0 112.77 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.675 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.6 mt -93.82 132.71 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 120.866 0.365 . . . . 0.0 110.468 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pt-20 -116.52 170.18 8.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.21 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.5 -39.53 10.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.47 -21.66 68.89 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.435 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.444 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 7.1 tp60 -100.66 -3.39 30.42 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.03 -170.9 2.55 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 178.211 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.573 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 57.4 m -136.36 98.18 3.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 111.617 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.575 HG21 ' CD2' ' A' ' 57' ' ' LEU . 5.7 mm -69.28 127.89 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.137 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -92.43 137.76 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -97.98 151.3 20.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.126 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.11 -31.22 8.9 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.975 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.789 ' CE1' HD21 ' A' ' 100' ' ' LEU . 10.3 t80 -103.64 105.17 15.32 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 120.894 0.378 . . . . 0.0 110.72 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -135.68 122.35 20.94 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.339 0.59 . . . . 0.0 110.639 179.589 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -140.9 148.33 40.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.917 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.866 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.8 pm0 -133.06 125.36 29.45 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.431 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.902 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.2 mt -91.95 116.68 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.046 179.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.81 129.92 56.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.829 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.567 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 19.4 p90 -166.75 141.76 4.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 92' ' ' LYS . 7.7 p -81.99 111.42 18.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.847 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.792 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -76.48 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.887 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -37.47 18.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.066 0.46 . . . . 0.0 110.932 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 177.64 26.44 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.534 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.785 ' HB3' HD11 ' A' ' 8' ' ' LEU . 2.7 tptt -155.11 120.85 2.62 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.848 ' O ' HD12 ' A' ' 8' ' ' LEU . 43.4 Cg_endo -68.73 117.84 5.27 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.372 2.715 . . . . 0.0 113.053 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.906 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -100.58 115.46 30.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.985 -179.356 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 48.0 m -86.28 120.75 27.97 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.715 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.2 t -116.67 108.12 24.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.014 -0.275 . . . . 0.0 111.692 -178.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.866 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -84.52 125.63 40.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.535 ' HB3' ' CD1' ' A' ' 14' ' ' ILE . 9.4 m-85 -113.15 130.75 56.1 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.144 -177.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.547 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.7 m-90 -114.9 156.86 24.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.698 178.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.789 HD21 ' CE1' ' A' ' 81' ' ' PHE . 2.1 mt -93.18 113.13 25.28 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.573 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -124.81 148.94 47.9 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.966 0.412 . . . . 0.0 111.788 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.603 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.2 OUTLIER -123.38 117.94 26.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.129 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.706 HG12 HD23 ' A' ' 75' ' ' LEU . 7.6 m -71.94 132.61 33.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.853 0.358 . . . . 0.0 110.367 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.85 -20.68 66.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.702 -178.283 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.724 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 60.3 t0 -111.89 120.57 42.38 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 8.1 t80 -58.98 -38.12 78.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.353 178.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -105.69 26.1 9.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.996 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.724 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.6 p -43.3 149.02 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.456 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.583 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -70.21 142.93 52.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.222 0.535 . . . . 0.0 111.298 -179.099 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.832 HG21 ' CG ' ' A' ' 119' ' ' TYR . 46.1 mm -120.15 99.67 7.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.758 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.895 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 3.9 mtp180 -98.77 100.4 11.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.913 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 34' ' ' LEU . 14.0 mt -90.3 153.7 20.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.77 -166.84 1.13 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.0 m80 -68.21 -1.45 6.16 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.37 -27.65 18.21 Favored 'General case' 0 C--N 1.335 -0.051 0 CA-C-O 120.838 0.351 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.543 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 23.5 m80 -127.15 141.38 51.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.689 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.543 ' HB2' ' HA ' ' A' ' 37' ' ' SER . 5.0 tp-100 -100.58 -17.64 16.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.082 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.44 169.44 13.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.971 0.415 . . . . 0.0 111.515 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.832 ' CG ' HG21 ' A' ' 110' ' ' ILE . 35.9 p90 -140.42 174.96 10.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.112 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.56 163.07 33.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.313 0.578 . . . . 0.0 111.682 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.485 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 72.4 m95 -128.83 107.67 9.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.047 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -142.43 166.68 24.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.18 0.514 . . . . 0.0 111.819 -178.185 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.32 -151.34 1.72 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.313 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.543 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.1 tp -76.98 -47.19 21.47 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.923 0.392 . . . . 0.0 111.19 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -56.88 -51.79 67.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.787 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.96 -48.93 61.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.949 0.404 . . . . 0.0 110.787 -179.086 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.484 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -54.66 -29.24 52.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.323 0.582 . . . . 0.0 109.926 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.1 m -84.46 -32.58 23.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.407 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.822 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.64 -43.56 84.31 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.808 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.682 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.1 mt -77.42 -42.91 34.38 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.2 51.86 1.24 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.466 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.93 -29.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.707 -179.194 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.504 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 13.7 m-85 -60.47 119.84 8.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.327 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.48 -48.37 19.1 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.876 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.902 ' HB3' HD13 ' A' ' 85' ' ' LEU . 34.0 mp0 -48.16 -54.58 12.89 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.666 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.691 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -65.13 -42.17 94.13 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.33 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.61 -39.32 61.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.059 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.552 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.28 -46.75 60.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.771 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.4 -49.76 60.95 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.665 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.509 HD12 ' O ' ' A' ' 136' ' ' MET . 0.3 OUTLIER -72.94 -32.02 64.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.953 178.876 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.552 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 2.4 mm-40 -59.66 -52.29 66.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.432 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 3.0 mt-10 -71.55 -27.48 63.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.949 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.98 -42.73 92.97 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.894 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -76.27 -36.58 58.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.016 0.436 . . . . 0.0 110.22 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -63.48 -52.6 60.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.05 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -65.33 -51.95 57.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.463 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.717 HD23 HD11 ' A' ' 150' ' ' ILE . 75.5 mt -56.96 -25.16 57.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.886 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.4 t -78.39 -18.64 54.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.747 0.308 . . . . 0.0 110.611 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.16 -12.21 36.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.697 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.717 HD11 HD23 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -84.78 -130.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.101 179.57 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.423 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 3.6 tt0 -170.22 -58.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.965 0.412 . . . . 0.0 110.555 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -159.68 -50.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.946 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.792 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.857 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.504 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.857 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 82.6 Cg_endo -72.39 171.88 16.11 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 124.315 3.344 . . . . 0.0 109.62 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 tt -59.81 128.66 38.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.902 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.17 83.82 0.34 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.754 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.3 p -169.41 -23.33 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.523 0.202 . . . . 0.0 111.42 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -72.86 125.36 27.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.795 0.331 . . . . 0.0 110.531 179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.91 174.3 0.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.109 0.481 . . . . 0.0 110.925 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.982 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.24 139.42 44.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.208 179.2 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.862 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtt180 -82.8 125.02 30.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.366 -179.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.733 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -137.64 165.93 25.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.991 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -160.59 123.82 3.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.298 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.577 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.02 172.3 14.16 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.72 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.682 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.5 OUTLIER -125.46 117.92 24.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -179.432 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 1.002 HD11 ' HB1' ' A' ' 139' ' ' ALA . 43.2 mt -83.74 92.02 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -82.45 146.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.982 -178.211 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.741 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 53.7 p90 -152.24 121.41 6.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.278 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 2.5 ptm180 -82.16 114.69 20.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.224 0.535 . . . . 0.0 110.25 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.421 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 23.8 ttp85 -98.08 124.07 42.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.248 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 160.16 28.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.606 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -50.38 -54.22 23.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.123 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.441 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.7 pp -146.2 150.15 40.58 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.222 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 16.6 Cg_exo -67.08 157.79 60.0 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.657 2.238 . . . . 0.0 112.184 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.65 -80.0 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.772 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.409 HG12 ' O ' ' A' ' 24' ' ' VAL . 22.6 t -91.2 -10.81 9.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.064 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 t0 71.48 7.96 6.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.184 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.1 t-20 -81.46 -80.01 0.16 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.806 0.336 . . . . 0.0 110.189 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -108.56 97.06 6.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.071 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.6 -46.6 3.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.404 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.741 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.2 mt -107.64 143.87 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 111.905 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.626 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -132.79 126.84 33.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.104 179.81 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.3 m-85 -89.71 151.68 21.73 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.609 HD23 ' CD1' ' A' ' 15' ' ' ILE . 47.8 tp -86.72 133.99 33.63 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.0 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.577 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.3 mt -135.23 144.33 46.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 112' ' ' LEU . 14.4 mt -123.61 113.24 18.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.086 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.491 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.5 tt0 -74.1 140.48 45.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.209 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.98 157.06 22.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.505 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.501 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 3.0 p -82.81 1.93 36.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.468 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -164.82 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.31 -121.3 7.46 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.343 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 40' ' ' ILE . 13.5 tt -93.44 0.55 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.819 0.342 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 58.67 32.51 22.25 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.886 0.374 . . . . 0.0 110.799 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.42 ' HB3' HG23 ' A' ' 40' ' ' ILE . 46.2 p-80 -67.02 142.12 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.764 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.694 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 46.6 m95 -98.71 140.79 32.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.67 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.793 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -163.27 142.59 6.66 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 -179.718 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 175.95 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.383 2.055 . . . . 0.0 112.105 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.684 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 6.8 Cg_exo -73.3 102.4 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.851 2.367 . . . . 0.0 112.428 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.7 OUTLIER -110.36 157.59 19.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.393 179.435 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -148.84 173.01 28.89 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.5 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 26.1 t-80 -99.29 110.53 23.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.862 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.92 134.6 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.726 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 8.6 tt0 -90.63 150.99 43.45 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.239 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.5 -21.82 19.78 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.861 2.374 . . . . 0.0 113.033 -178.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.725 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.64 -9.75 42.71 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.337 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -89.64 171.49 9.64 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.607 0.241 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.926 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.9 t70 -87.84 160.98 17.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.046 0.45 . . . . 0.0 110.651 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.588 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 16.7 m-20 -71.52 -58.99 3.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.146 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 77' ' ' ILE . 23.0 tp -65.97 -42.13 90.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.211 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.926 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.82 -42.54 47.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.7 0.286 . . . . 0.0 110.503 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.541 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 98.5 m -60.48 -44.08 96.3 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.17 -30.35 67.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.879 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.847 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.8 mt -71.83 -51.98 19.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.354 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -60.61 -42.35 96.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.593 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 66' ' ' GLU . . . -59.52 -33.58 71.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.178 0.513 . . . . 0.0 109.779 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 66.5 m -59.14 -53.64 56.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.301 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.534 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.7 pt20 -72.6 -20.94 61.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.028 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 1.5 mm-40 -77.96 -40.25 39.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.841 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 59.1 mm-40 -111.34 12.8 21.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.346 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -154.54 -11.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.618 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.05 2.41 46.86 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.291 -0.957 . . . . 0.0 113.123 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.673 ' O ' HG22 ' A' ' 64' ' ' THR . 1.5 mt -105.47 129.65 58.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.815 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.8 pm0 -110.17 172.38 6.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.648 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.27 -36.26 20.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.15 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.68 -18.96 72.65 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.062 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.517 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 4.7 mt-30 -100.76 -5.02 26.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.546 0.213 . . . . 0.0 111.28 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.936 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -132.75 -170.15 2.39 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.417 177.943 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.561 ' H ' ' H ' ' A' ' 102' ' ' GLU . 55.2 m -133.54 100.37 4.78 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.049 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 57' ' ' LEU . 17.7 mm -74.39 123.38 29.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.242 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.592 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -83.32 139.06 18.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -97.88 144.98 26.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.173 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.2 -23.52 31.72 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.884 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.583 ' CE1' HD21 ' A' ' 100' ' ' LEU . 11.0 t80 -103.44 128.55 50.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.155 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.483 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -157.98 130.98 7.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.265 179.485 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -151.99 137.27 17.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.913 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.95 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -120.52 134.07 55.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.134 0.492 . . . . 0.0 112.04 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.9 mt -96.32 121.19 37.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -111.68 123.71 50.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 0.0 110.731 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.56 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 27.1 p90 -166.95 141.58 3.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.037 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.582 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.5 p -83.6 112.69 21.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.689 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.538 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -75.7 -97.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.674 -178.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -74.05 -36.29 64.36 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.777 0.322 . . . . 0.0 110.943 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.44 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 1.5 t30 178.98 24.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.218 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.802 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.6 tptt -155.32 126.95 3.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 110.891 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.906 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.3 Cg_endo -69.5 119.89 6.79 Favored 'Trans proline' 0 CA--C 1.515 -0.438 0 C-N-CA 123.437 2.758 . . . . 0.0 112.876 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.982 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.9 mmmt -101.51 129.39 47.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.04 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.4 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 24.2 m -95.49 114.62 26.4 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.763 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.4 t -113.75 107.76 23.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.95 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.37 120.33 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.694 ' HB3' HG13 ' A' ' 14' ' ' ILE . 8.5 m-85 -104.17 128.53 51.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.042 0.448 . . . . 0.0 111.705 -178.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.588 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 7.9 m-90 -114.4 152.8 30.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.437 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.583 HD21 ' CE1' ' A' ' 81' ' ' PHE . 1.1 mt -88.59 121.37 30.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.8 144.71 51.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.561 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.9 tt0 -122.83 113.85 19.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.387 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.936 HG12 HD23 ' A' ' 75' ' ' LEU . 17.4 m -72.78 115.45 13.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 121.399 0.619 . . . . 0.0 110.869 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.517 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -60.24 -26.74 66.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.662 -178.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.914 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 2.1 m-20 -93.8 110.1 21.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.19 0.519 . . . . 0.0 111.501 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -58.38 -38.49 77.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.09 26.13 9.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.807 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.914 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.9 p -47.85 149.45 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.419 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -73.39 142.31 46.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.134 0.493 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.77 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.9 mm -118.27 99.65 8.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.618 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.1 OUTLIER -103.2 97.96 7.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.127 -179.457 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 34' ' ' LEU . 5.5 mt -84.71 -177.75 6.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.775 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 67' ' ' GLU . 0.3 OUTLIER -120.44 -166.14 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.677 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -68.58 -14.99 63.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.685 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.61 23.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.687 0.279 . . . . 0.0 111.405 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.51 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 35.6 m80 -119.76 122.08 40.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.899 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.501 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 3.3 pt20 -103.75 -7.67 20.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.601 -179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -165.7 154.78 11.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.047 0.451 . . . . 0.0 111.24 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.77 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.6 p90 -134.45 171.61 14.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.493 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -157.78 157.82 34.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.211 0.529 . . . . 0.0 111.506 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.581 ' C ' ' HG2' ' A' ' 30' ' ' GLU . 73.3 m95 -122.47 109.55 14.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.521 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.715 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.94 170.67 15.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.007 0.432 . . . . 0.0 111.458 -178.651 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.43 -155.13 4.95 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.075 179.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.2 tp -75.17 -41.23 58.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.652 0.263 . . . . 0.0 111.084 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.3 pt-20 -62.3 -51.24 68.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.715 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -70.37 -45.54 65.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.0 0.428 . . . . 0.0 110.479 -179.525 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.577 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -57.73 -29.98 65.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.238 0.542 . . . . 0.0 109.692 178.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 4.2 m -83.91 -32.1 25.3 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.32 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.9 OUTLIER -64.59 -44.27 91.16 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.694 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -77.13 -43.98 32.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.923 179.119 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.27 53.61 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.91 -30.57 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.571 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 12.1 m-85 -60.28 118.49 6.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.426 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -46.4 -46.62 18.69 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.237 0.541 . . . . 0.0 111.693 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.9 mp0 -50.84 -54.46 23.58 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.981 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.793 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.19 -42.62 99.46 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.136 -179.55 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -34.7 40.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 110.148 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.559 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.75 -47.45 25.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.939 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 1.002 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.94 -41.73 62.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.088 0.47 . . . . 0.0 110.207 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.55 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -78.69 -28.18 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.601 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -66.36 -52.02 51.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.05 -32.77 69.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.483 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.07 -39.78 90.29 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.215 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.6 OUTLIER -80.4 -31.25 37.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.863 0.363 . . . . 0.0 110.588 179.652 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.54 -52.55 57.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.366 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.01 -53.55 48.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.927 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.592 ' CD2' HG12 ' A' ' 78' ' ' ILE . 86.8 mt -55.35 -39.79 70.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.921 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 14.5 t -60.75 -15.64 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.713 0.292 . . . . 0.0 110.888 179.337 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.63 -14.9 27.51 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.45 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.584 HD11 HD23 ' A' ' 147' ' ' LEU . 2.1 mt -81.69 -129.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.793 -0.185 . . . . 0.0 110.544 -179.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.591 ' O ' HD12 ' A' ' 153' ' ' LEU . 12.1 pt-20 -90.55 3.19 54.73 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.41 60.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.586 0.231 . . . . 0.0 111.417 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.591 HD12 ' O ' ' A' ' 151' ' ' GLU . 1.3 mp . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.959 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.56 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.577 ' O ' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.539 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 131.06 17.08 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 124.338 3.359 . . . . 0.0 109.619 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.577 HD23 ' O ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -159.91 98.83 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.89 0.376 . . . . 0.0 111.067 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.54 134.75 1.73 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.541 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.3 t -67.45 139.31 57.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.892 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.439 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 10.5 tpt -75.82 123.14 25.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.0 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 70.02 164.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.646 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.914 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.75 130.4 54.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.602 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.619 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.07 111.95 19.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.864 179.753 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.806 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -124.71 173.45 8.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.887 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 6.5 m -161.73 124.06 2.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.14 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -115.06 170.67 13.34 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.615 HD11 HD23 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -122.72 117.95 26.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.478 0.639 . . . . 0.0 111.687 -179.438 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.916 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.1 mt -82.24 91.17 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.638 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 177.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.916 HD11 HG23 ' A' ' 64' ' ' THR . 19.6 mt -79.57 143.23 12.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.833 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.726 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 32.7 p90 -148.5 122.26 9.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.277 -178.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 103' ' ' VAL . 63.2 mtm180 -80.79 114.2 19.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.643 ' NH1' ' HB3' ' A' ' 152' ' ' ALA . 15.9 ttm180 -82.46 113.47 20.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.81 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.5 p -72.36 160.62 32.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.544 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.6 mt -59.72 -80.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.547 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.729 ' H ' HD13 ' A' ' 21' ' ' ILE . 0.2 OUTLIER -125.91 148.11 61.45 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 36.4 Cg_exo -60.69 156.46 42.56 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.577 2.185 . . . . 0.0 112.344 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -77.97 0.52 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.805 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 m -133.47 -37.55 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.327 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 164.61 25.41 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.695 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -60.22 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.897 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 2.2 m-80 -149.71 -29.78 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.806 0.336 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 70.07 -61.91 0.44 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.741 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.726 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.3 mt -102.27 151.13 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.411 0.624 . . . . 0.0 112.377 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.664 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 41.8 mt-10 -135.33 139.69 44.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.422 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.9 m-85 -101.36 152.42 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 23.6 tp -85.17 138.59 32.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.931 179.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.3 mt -138.37 136.22 36.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.502 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.703 HD11 ' HG3' ' A' ' 46' ' ' PRO . 13.6 mt -113.84 113.04 24.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.654 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 6.2 tp60 -66.12 126.6 29.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 110.868 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.56 127.14 30.04 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.9 p -73.13 4.58 4.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.484 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -174.42 172.48 3.16 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-O 120.804 0.335 . . . . 0.0 110.433 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.36 -123.27 7.85 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.353 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.612 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.3 pt -99.24 9.46 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.498 0.19 . . . . 0.0 111.355 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.8 m-70 62.85 41.05 9.1 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.418 0.628 . . . . 0.0 109.483 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.612 ' HB3' HD11 ' A' ' 40' ' ' ILE . 6.9 p-80 -88.21 163.43 16.14 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.233 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.664 ' HB3' HD22 ' A' ' 33' ' ' LEU . 77.0 m95 -112.81 120.31 41.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.532 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.581 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.9 OUTLIER -145.32 130.91 9.39 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 31.2 Cg_exo -58.49 175.95 0.48 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.075 1.85 . . . . 0.0 111.594 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.721 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.8 Cg_exo -57.78 105.02 0.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.501 2.134 . . . . 0.0 112.78 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HE3' ' HB ' ' A' ' 44' ' ' THR . 8.9 mtmp? -101.22 144.73 29.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.704 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.463 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -122.82 -162.67 11.6 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.564 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.54 96.0 3.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.94 0.4 . . . . 0.0 110.642 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.695 ' N ' HG21 ' A' ' 59' ' ' THR . 2.1 p -77.88 132.85 31.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.828 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.57 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -96.98 179.17 1.16 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.107 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.1 Cg_exo -57.01 -59.06 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.145 1.897 . . . . 0.0 112.593 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.65 2.29 87.55 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.47 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.52 ' H ' ' HG2' ' A' ' 51' ' ' GLU . 9.7 tt0 -80.21 174.01 12.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.789 0.328 . . . . 0.0 110.6 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.858 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.7 t70 -94.39 153.77 17.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.216 0.532 . . . . 0.0 110.432 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.603 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -72.14 -63.37 1.15 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.286 -179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 77' ' ' ILE . 20.7 tp -63.97 -39.54 94.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.618 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.858 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.76 -49.93 56.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.666 0.27 . . . . 0.0 110.745 -179.782 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.695 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.5 m -54.03 -40.8 67.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.505 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -73.79 -28.73 61.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 178.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.709 HD22 ' HB2' ' A' ' 72' ' ' ALA . 90.1 mt -74.94 -53.49 8.91 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.75 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -59.81 -38.22 81.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.419 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.89 -36.11 82.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.023 0.44 . . . . 0.0 109.962 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.916 HG23 HD11 ' A' ' 15' ' ' ILE . 14.0 m -60.13 -55.91 28.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.597 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.571 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -70.16 -22.11 63.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.868 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -79.06 -40.19 31.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.897 0.38 . . . . 0.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 96.1 mt-10 -109.91 11.24 24.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.44 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -155.47 -6.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.51 0.31 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.819 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.763 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.7 mt -103.06 121.14 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 117.049 0.425 . . . . 0.0 110.48 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.4 pt-20 -108.66 173.27 6.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.082 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.97 -37.58 32.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.381 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.36 -16.14 73.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.153 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.512 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 1.6 tp60 -102.49 -4.41 25.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.524 0.202 . . . . 0.0 111.261 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -134.39 -174.07 3.46 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.857 0.36 . . . . 0.0 110.219 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.556 ' H ' ' H ' ' A' ' 102' ' ' GLU . 51.4 m -130.48 100.96 5.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.29 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 57' ' ' LEU . 14.7 mm -74.1 129.34 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.397 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.514 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -92.27 139.58 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.528 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -98.74 151.41 20.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.0 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -26.42 24.15 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.453 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.611 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 11.1 t80 -104.3 127.35 51.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.017 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.465 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.4 ttpt -158.12 125.7 5.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.154 0.502 . . . . 0.0 111.662 179.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 139.91 25.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.551 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.896 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.7 OUTLIER -120.96 132.84 55.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.921 0.391 . . . . 0.0 111.429 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.8 mt -98.25 116.93 31.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.615 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.5 m-80 -107.22 125.38 51.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.378 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.574 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 27.5 p90 -167.37 143.18 4.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.092 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.593 HG23 ' CA ' ' A' ' 92' ' ' LYS . 8.3 p -83.66 106.45 14.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.626 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.497 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -79.23 -101.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.837 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 6.0 ptt180 -57.16 -41.41 79.15 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.424 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 6.6 p-10 172.55 29.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.376 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -157.73 128.96 3.75 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.292 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.914 ' O ' HD12 ' A' ' 8' ' ' LEU . 40.8 Cg_endo -66.86 121.33 8.52 Favored 'Trans proline' 0 CA--C 1.514 -0.48 0 C-N-CA 123.287 2.658 . . . . 0.0 112.525 -179.415 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.806 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -104.92 123.65 48.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.895 -178.63 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 97.4 m -91.24 106.31 18.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.6 t -108.5 108.46 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.896 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.58 127.54 40.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.042 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.658 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.0 m-85 -115.35 130.0 56.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.603 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 15.0 m-90 -111.09 169.65 8.63 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.134 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 81' ' ' PHE . 1.1 mt -102.95 112.32 25.09 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.34 151.2 40.38 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.556 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.6 tt0 -125.88 112.24 15.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.414 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.768 HG12 HD23 ' A' ' 75' ' ' LEU . 5.0 m -72.07 112.92 8.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.548 0.69 . . . . 0.0 110.79 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 2.0 ptpt -58.01 -27.16 63.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.225 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.899 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 16.2 m-20 -94.32 111.06 22.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.203 0.525 . . . . 0.0 111.593 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.454 ' CE1' ' NH1' ' A' ' 17' ' ' ARG . 17.0 t80 -57.67 -39.99 78.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.422 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -103.86 27.34 7.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.715 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.899 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -46.9 151.53 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.749 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.535 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.2 OUTLIER -76.8 144.75 38.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.294 0.568 . . . . 0.0 111.231 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.875 HG21 ' CD1' ' A' ' 119' ' ' TYR . 44.9 mm -121.63 99.3 6.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.967 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.68 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -98.77 101.83 13.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.926 -178.669 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.591 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.4 mt -95.94 140.41 30.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.73 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.7 p -83.08 -164.94 0.95 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.414 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -72.86 -4.53 32.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.501 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -91.47 -22.89 20.18 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.603 0.239 . . . . 0.0 111.426 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 94.2 m-70 -120.84 129.36 53.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.017 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -98.74 -12.53 20.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.573 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.39 173.73 6.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.418 . . . . 0.0 111.436 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.875 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.8 p90 -146.68 174.64 11.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.578 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 49.7 mtt180 -156.12 153.6 29.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 111.745 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 95.2 m95 -119.02 107.67 13.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.276 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.2 167.42 21.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 111.51 -178.654 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.67 -152.6 3.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.1 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' CD ' ' A' ' 141' ' ' GLN . 8.4 tp -77.25 -43.42 33.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.684 0.278 . . . . 0.0 111.292 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.2 pt-20 -59.91 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.665 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.892 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.28 -43.76 60.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.055 -179.434 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.45 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -59.36 -29.82 67.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.361 0.601 . . . . 0.0 109.747 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.7 m -84.84 -33.71 22.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.49 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.892 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.67 -43.51 84.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.559 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.586 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -75.27 -45.73 38.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 127' ' ' ALA . . . -80.43 54.44 2.04 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.105 0.479 . . . . 0.0 109.865 178.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.0 -33.59 0.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.566 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.534 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 4.4 m-85 -54.2 119.52 5.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.108 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -45.98 -47.72 16.61 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.302 0.572 . . . . 0.0 111.354 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.922 ' HB3' HD13 ' A' ' 85' ' ' LEU . 26.0 mp0 -49.66 -57.14 7.77 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.911 -179.261 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.451 ' HA ' ' HE3' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.14 -46.86 87.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.398 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.02 -41.36 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.169 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.97 -47.38 65.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.411 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.916 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.15 -41.98 63.01 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.38 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.45 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.4 OUTLIER -81.65 -28.19 33.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.119 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.532 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.63 -52.56 43.76 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.22 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.611 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -74.47 -25.37 59.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 -179.769 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.531 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.53 -47.64 88.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.472 -0.871 . . . . 0.0 111.771 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.684 ' NE2' HD12 ' A' ' 29' ' ' ILE . 5.9 t-160 -76.08 -29.67 58.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.962 0.41 . . . . 0.0 110.655 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -68.95 -52.81 25.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -61.52 -47.57 85.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.856 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.611 HD23 HD11 ' A' ' 150' ' ' ILE . 65.0 mt -54.29 -44.48 71.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.593 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.6 -11.99 59.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.926 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.16 -13.69 26.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.439 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.611 HD11 HD23 ' A' ' 147' ' ' LEU . 1.5 mt -80.49 -130.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.609 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.424 ' O ' HD12 ' A' ' 153' ' ' LEU . 0.6 OUTLIER -95.28 -67.23 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 111.17 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.643 ' HB3' ' NH1' ' A' ' 18' ' ' ARG . . . -67.37 142.09 56.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.485 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 151' ' ' GLU . 5.9 mp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.835 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.574 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.576 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.483 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.36 -33.32 9.12 Favored 'Trans proline' 0 N--CA 1.448 -1.194 0 C-N-CA 124.354 3.369 . . . . 0.0 109.575 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.3 tp 61.97 91.85 0.06 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.349 . . . . 0.0 110.76 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.72 -40.91 3.73 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.54 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -81.18 109.84 16.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.682 0.277 . . . . 0.0 110.983 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.6 tpt -178.56 155.61 0.85 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.943 0.402 . . . . 0.0 111.015 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.625 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 66.4 169.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.362 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.947 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -111.09 138.66 47.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.01 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.766 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -84.25 112.84 20.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.578 179.432 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 95' ' ' THR . . . -124.71 170.73 10.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.258 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -163.16 124.48 2.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.087 0.47 . . . . 0.0 111.115 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.639 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -118.52 177.61 16.5 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.583 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -131.2 118.12 19.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.028 0.414 . . . . 0.0 111.762 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.783 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.4 mt -82.73 92.08 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 32.7 mt -83.73 145.16 8.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.444 -177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.744 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.2 122.47 7.21 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.284 -179.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.65 112.94 18.49 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.124 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.7 OUTLIER -95.6 105.41 17.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.436 -179.474 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.39 160.81 18.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.714 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.51 -78.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.416 HD12 ' O ' ' A' ' 22' ' ' PRO . 2.8 pp -119.21 157.1 51.91 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.737 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.416 ' O ' HD12 ' A' ' 21' ' ' ILE . 52.1 Cg_exo -54.83 143.89 69.05 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.439 2.092 . . . . 0.0 112.414 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HA ' ' HE2' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -104.17 -81.87 0.51 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.065 -179.889 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.509 HG12 ' O ' ' A' ' 24' ' ' VAL . 6.1 t -103.4 6.3 10.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.758 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 64.96 34.32 9.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.839 0.352 . . . . 0.0 110.989 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -102.94 -58.33 1.89 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 110.505 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -154.25 105.37 2.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.567 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.58 -33.69 58.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.35 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.744 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -115.12 146.44 19.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.239 0.542 . . . . 0.0 112.149 -179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.605 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 20.5 mt-10 -136.35 129.68 31.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.926 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.642 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 63.7 m-85 -91.64 150.01 21.36 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.62 HD23 HD12 ' A' ' 15' ' ' ILE . 55.1 tp -84.82 133.73 34.32 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -134.98 141.18 46.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.639 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.603 HD11 ' HG3' ' A' ' 46' ' ' PRO . 14.4 mt -119.09 121.47 39.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.184 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.608 ' NE2' ' CZ2' ' A' ' 43' ' ' TRP . 11.7 tt0 -61.42 162.48 7.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.59 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.499 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . . . -90.73 -10.98 40.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.795 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.53 ' H ' ' HG2' ' A' ' 35' ' ' GLN . 8.2 p 73.8 -59.4 0.56 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.77 0.319 . . . . 0.0 110.93 -179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -117.54 171.41 8.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.41 -125.65 7.44 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.519 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 40' ' ' ILE . 12.7 tt -88.87 -2.68 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.499 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 2.3 m80 60.73 33.19 20.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.97 0.414 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 -61.6 140.56 58.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.657 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.707 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 40.8 m95 -101.66 119.79 39.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -139.59 141.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.797 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.94 166.48 2.99 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.516 2.144 . . . . 0.0 112.09 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 24.3 Cg_exo -63.33 82.67 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.751 2.301 . . . . 0.0 112.132 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.458 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 12.8 pttm -87.05 156.22 19.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.085 0.469 . . . . 0.0 111.335 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.23 -178.86 19.42 Favored Glycine 0 N--CA 1.45 -0.371 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.302 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.478 ' NE2' ' HB3' ' A' ' 8' ' ' LEU . 4.8 t-80 -108.49 118.69 37.43 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.766 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -93.06 134.79 29.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.256 0.55 . . . . 0.0 111.25 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.696 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 5.1 tt0 -93.52 152.06 40.63 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.878 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.5 Cg_endo -54.23 -22.04 24.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.644 2.23 . . . . 0.0 112.58 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.696 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.07 -14.35 36.56 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.795 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -83.06 168.15 17.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.66 0.267 . . . . 0.0 110.671 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 1.047 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 27.4 t70 -85.69 161.65 19.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.114 0.483 . . . . 0.0 110.747 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.52 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -72.05 -63.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 -179.824 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.601 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 22.7 tp -66.66 -39.4 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.962 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 1.047 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.3 tt0 -49.69 -46.76 50.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.452 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 96.9 m -58.85 -47.59 84.33 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -65.75 -29.81 70.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.085 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.834 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.8 mt -72.18 -53.53 12.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.948 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -64.02 -33.05 74.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.567 -179.85 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.95 -32.15 72.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.028 0.442 . . . . 0.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 23.1 m -60.46 -51.17 70.61 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.499 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.531 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -75.54 -20.6 58.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.07 179.673 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.3 tm-20 -78.32 -38.28 42.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.056 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.608 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 96.3 mt-10 -110.25 -0.66 17.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.8 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -141.37 -10.9 0.94 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.647 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 75.26 -4.51 40.3 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.111 -1.042 . . . . 0.0 113.088 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.851 HD11 ' CD1' ' A' ' 110' ' ' ILE . 4.5 mt -100.71 126.95 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.085 0.469 . . . . 0.0 111.278 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.0 pt-20 -109.96 170.44 8.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.786 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.98 -38.89 11.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.039 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.95 -22.77 70.69 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.247 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.594 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.0 OUTLIER -98.67 -1.9 39.63 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.476 0.179 . . . . 0.0 111.244 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -136.95 -169.63 2.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.201 178.148 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.589 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 24.4 m -136.34 99.68 4.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.609 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.597 HG21 HD21 ' A' ' 57' ' ' LEU . 8.4 mm -72.01 123.57 26.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.968 0.413 . . . . 0.0 111.009 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.515 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.87 139.23 17.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.777 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -98.75 151.7 20.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.097 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.1 -23.75 33.48 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.06 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.575 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 7.4 t80 -108.88 127.24 53.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -159.01 127.79 5.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.214 0.53 . . . . 0.0 111.645 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.469 HH12 ' HG2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -153.81 141.52 20.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.851 179.099 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.862 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.86 132.53 54.62 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.178 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 135' ' ' GLU . 10.7 mt -94.54 118.74 32.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.351 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -105.72 126.02 51.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 19.9 p90 -166.57 141.09 4.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.599 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.2 p -80.72 113.33 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.878 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.528 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -76.19 -107.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.369 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -61.65 -42.35 98.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.964 0.411 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -176.69 26.83 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.808 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.48 128.18 4.15 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.761 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.6 Cg_endo -72.22 116.0 4.54 Favored 'Trans proline' 0 CA--C 1.506 -0.895 0 C-N-CA 123.173 2.582 . . . . 0.0 112.404 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.668 ' HD3' ' CG2' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -105.93 122.2 45.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.791 -179.205 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.583 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 22.9 m -79.47 120.27 23.64 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.708 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 9.5 t -115.0 108.72 26.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.815 -178.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.862 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.42 133.59 29.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.716 ' HB3' HG13 ' A' ' 14' ' ' ILE . 77.6 m-85 -118.11 129.85 55.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.107 0.48 . . . . 0.0 111.743 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 10.6 m-90 -117.47 139.57 50.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.934 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.496 HD12 HG21 ' A' ' 78' ' ' ILE . 1.1 mt -76.58 116.17 17.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -126.94 146.37 50.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 110.681 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.57 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.1 tm-20 -122.77 116.93 24.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.551 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 12.9 m -73.12 120.65 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.371 0.605 . . . . 0.0 110.422 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -28.96 69.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.121 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.783 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 51.4 t0 -98.72 128.21 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.064 0.459 . . . . 0.0 111.978 -179.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.56 -42.24 61.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.436 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -91.25 19.7 5.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.483 178.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.783 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.4 p -47.69 143.58 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.927 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -66.35 142.55 57.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.468 0.652 . . . . 0.0 111.649 -178.994 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.851 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.96 95.36 3.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.953 179.129 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.647 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.3 mtp180 -95.22 101.34 13.07 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.727 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.75 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 12.2 mt -95.42 151.88 18.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.86 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.3 m -81.38 -169.03 2.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.109 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.25 6.12 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.535 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -102.23 -32.11 10.23 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.612 0.244 . . . . 0.0 111.149 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.75 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 51.9 m-70 -97.16 113.47 25.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.974 0.416 . . . . 0.0 111.078 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.518 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 4.7 tp-100 -76.19 -19.46 58.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.699 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.77 -177.12 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.0 111.94 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.709 ' CG ' HG21 ' A' ' 110' ' ' ILE . 36.3 p90 -151.01 162.73 40.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.992 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.707 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -150.67 141.64 22.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.266 0.555 . . . . 0.0 111.681 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -98.79 107.64 20.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.222 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.09 168.31 19.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.814 -177.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.5 -152.02 4.17 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.599 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.469 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.7 tp -77.0 -40.94 44.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.826 0.346 . . . . 0.0 111.044 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 15.6 pt-20 -61.0 -51.18 70.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.866 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.719 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -72.69 -32.97 66.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 0.0 110.703 -179.334 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.533 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -69.91 -29.69 66.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.357 0.599 . . . . 0.0 109.497 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.43 -31.36 24.66 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.429 178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.7 OUTLIER -66.64 -45.51 78.78 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.782 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.8 mt -74.09 -44.82 52.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.67 51.98 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.191 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.488 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.1 -28.35 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.67 -179.494 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -58.11 117.41 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.405 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.523 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 1.2 tttm -46.06 -44.98 15.85 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 111.778 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.763 ' HB3' HD13 ' A' ' 85' ' ' LEU . 20.9 mp0 -53.47 -53.36 52.51 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.624 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.97 -49.64 75.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.746 0.308 . . . . 0.0 111.394 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.523 ' HZ2' ' HA ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -48.65 -39.61 24.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.11 179.656 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.88 -46.45 57.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.069 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.783 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.7 -41.47 66.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.161 0.505 . . . . 0.0 109.972 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.47 -27.93 41.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.174 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.01 -52.6 40.51 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.568 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.575 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 2.4 mp0 -73.75 -25.48 60.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.572 -179.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.459 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -62.09 -43.12 99.59 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.378 -0.915 . . . . 0.0 111.108 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.462 ' NE2' HD12 ' A' ' 29' ' ' ILE . 4.8 t-80 -79.75 -31.92 41.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.027 0.442 . . . . 0.0 109.995 178.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLN . . . . . 0.405 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 13.6 tp60 -65.53 -50.88 63.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.743 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.42 ' CD1' HD11 ' A' ' 150' ' ' ILE . 49.7 t80 -63.16 -50.51 70.11 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.732 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.619 HD23 HD11 ' A' ' 150' ' ' ILE . 97.8 mt -55.67 -30.6 61.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.98 -18.83 60.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.691 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.4 -9.86 40.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.422 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.619 HD11 HD23 ' A' ' 147' ' ' LEU . 1.0 OUTLIER -86.17 -130.38 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.436 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.423 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 0.6 OUTLIER -172.79 -68.22 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.937 0.398 . . . . 0.0 110.571 -179.994 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 151' ' ' GLU . . . 176.39 177.36 0.25 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.837 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.593 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.805 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.805 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 82.4 Cg_endo -72.45 29.43 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 124.298 3.332 . . . . 0.0 109.59 179.4 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.517 ' H ' ' C ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -59.87 125.69 24.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.709 0.29 . . . . 0.0 110.946 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.455 ' N ' HD13 ' A' ' 3' ' ' LEU . . . -153.19 -120.72 0.82 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.573 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.9 p -59.51 129.17 40.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.557 0.218 . . . . 0.0 111.019 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 6' ' ' MET . 0.9 OUTLIER -62.36 100.8 0.19 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.853 0.359 . . . . 0.0 110.535 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 52.47 173.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.265 0.555 . . . . 0.0 110.993 -179.739 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.895 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -117.92 140.31 49.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.809 178.839 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.702 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -84.56 133.11 34.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.748 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.453 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -150.66 166.34 30.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.596 179.281 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 96.4 m -155.25 124.59 6.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.916 0.388 . . . . 0.0 111.515 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.627 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -112.06 172.59 14.89 Favored Glycine 0 N--CA 1.452 -0.292 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 178.736 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.61 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -127.14 117.76 23.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.294 0.547 . . . . 0.0 111.487 -179.931 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.94 HD11 ' HB1' ' A' ' 139' ' ' ALA . 74.3 mt -84.03 91.53 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.038 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 10.3 mt -83.11 146.2 7.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.172 -178.501 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.753 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.6 p90 -151.82 122.95 7.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.961 -178.755 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.771 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.83 111.64 17.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.949 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.64 108.51 18.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.74 151.54 21.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.867 -179.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.724 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.3 pt? -57.45 -45.61 84.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.0 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.724 HG23 ' O ' ' A' ' 20' ' ' LEU . 1.3 pp -173.7 155.16 2.49 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.716 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -66.95 149.01 82.94 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.644 2.23 . . . . 0.0 112.39 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.416 ' HE3' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -103.35 -80.79 0.52 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.422 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.7 m -134.86 -39.7 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.778 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -135.81 45.83 2.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.561 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -161.32 117.24 2.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.116 179.492 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -67.84 -170.45 0.16 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.723 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.9 -72.58 0.24 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.417 -179.722 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.753 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 11.2 mt -99.58 147.83 6.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.376 0.607 . . . . 0.0 111.866 -179.17 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.7 mt-10 -136.74 122.94 20.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.306 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.6 m-85 -87.39 141.91 28.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.934 -178.877 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.56 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 38.3 tp -79.97 133.61 36.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -136.65 137.0 39.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.538 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.562 HD22 HD22 ' A' ' 112' ' ' LEU . 12.6 mt -113.8 125.9 54.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.985 -179.533 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.561 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 2.1 tt0 -57.82 168.61 0.88 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.394 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.71 -26.04 22.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.126 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.734 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 2.8 p 78.77 -15.87 0.72 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.868 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -158.63 -169.1 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.22 20.6 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.614 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.526 HG12 ' O ' ' A' ' 40' ' ' ILE . 11.9 tt -91.08 -1.91 10.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.635 0.255 . . . . 0.0 111.358 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 63.56 26.41 14.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.52 159.38 10.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.842 179.803 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.577 ' O ' HG23 ' A' ' 44' ' ' THR . 50.6 m95 -111.7 135.6 52.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.021 -179.915 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 ' O ' ' A' ' 43' ' ' TRP . 6.6 p -160.95 147.72 11.79 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.671 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.439 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 23.8 Cg_endo -61.36 169.44 6.51 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.574 2.183 . . . . 0.0 112.202 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 63.6 Cg_endo -75.54 108.59 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.798 2.332 . . . . 0.0 112.388 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.0 pttp -106.36 141.15 38.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 111.295 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 63' ' ' ALA . . . -110.83 -161.74 17.77 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.964 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 11.0 m-70 -130.04 105.12 7.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.702 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -78.22 113.93 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 121.295 0.569 . . . . 0.0 110.976 -179.783 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.653 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -74.52 177.99 1.93 Allowed Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.578 -179.919 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.653 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.3 Cg_exo -56.84 -50.04 12.76 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.338 2.026 . . . . 0.0 112.771 -179.518 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -96.06 12.88 66.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.908 -179.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -86.5 167.29 14.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.994 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.3 t70 -92.21 158.71 16.0 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.18 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.47 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 2.9 m-20 -73.08 -61.46 1.81 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.304 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.679 HD13 ' CD2' ' A' ' 99' ' ' TRP . 17.9 tp -63.2 -39.78 95.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 0.0 110.935 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.84 -50.78 44.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 110.862 -179.897 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.58 HG21 ' N ' ' A' ' 50' ' ' VAL . 56.3 m -55.63 -41.49 73.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.59 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.25 -30.32 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.996 178.357 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.75 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.9 mt -72.76 -52.25 15.81 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.272 179.133 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.47 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.58 -40.65 95.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.811 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.456 ' HB2' ' CA ' ' A' ' 48' ' ' GLY . . . -60.31 -36.5 78.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -59.78 -58.07 10.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.855 179.299 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.556 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.7 pt20 -68.91 -21.8 64.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.47 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 22.5 mt-10 -79.03 -42.87 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.358 . . . . 0.0 110.958 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.58 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.8 mp0 -103.79 1.78 32.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.742 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.54 -5.87 0.73 Allowed 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -179.804 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.7 -1.59 9.61 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.141 -1.028 . . . . 0.0 112.811 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.736 ' O ' HG22 ' A' ' 64' ' ' THR . 1.6 mt -103.06 125.07 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.308 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -111.38 173.55 6.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.741 -179.619 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.42 -38.27 28.54 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.629 179.402 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.71 -14.46 60.57 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.449 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -106.98 -15.44 14.7 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.821 0.311 . . . . 0.0 111.453 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.833 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -123.65 -175.13 3.14 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.939 0.399 . . . . 0.0 110.449 178.623 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.546 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 43.0 m -129.27 100.76 5.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.094 -179.58 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.672 HG21 HD21 ' A' ' 57' ' ' LEU . 13.2 mm -72.82 115.09 13.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.762 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.474 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -75.91 136.01 25.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -93.76 151.61 19.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.338 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.24 -23.51 35.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.292 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.757 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.7 t80 -107.29 127.03 53.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.789 0.328 . . . . 0.0 111.174 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.6 ttpt -158.72 125.12 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 179.637 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.92 145.05 31.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.085 179.403 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.83 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.9 OUTLIER -126.17 126.38 44.01 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.224 179.852 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.7 mt -90.68 120.06 31.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.4 m120 -110.47 124.22 51.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 -179.499 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.627 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 18.3 p90 -166.87 137.85 3.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.966 0.412 . . . . 0.0 111.126 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.569 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -76.33 113.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.345 0.593 . . . . 0.0 110.889 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.479 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -79.82 -105.56 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.819 -178.72 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 1.6 ptt-85 -63.45 -35.92 82.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.978 0.418 . . . . 0.0 110.394 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 90' ' ' ARG . 9.6 t-20 176.28 27.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.969 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.794 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.27 128.04 3.87 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 0.0 110.981 -179.968 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.895 ' O ' HD12 ' A' ' 8' ' ' LEU . 44.0 Cg_endo -70.18 118.69 5.83 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.422 2.748 . . . . 0.0 113.099 -179.226 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.862 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.2 mmmt -99.26 130.2 45.54 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.144 -179.374 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.8 m -95.6 107.16 19.33 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.748 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 44.8 t -107.13 108.0 24.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.789 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.83 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.13 128.71 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.519 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.577 ' HB3' HG13 ' A' ' 14' ' ' ILE . 10.6 m-85 -108.54 163.25 13.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.334 0.588 . . . . 0.0 111.439 -178.83 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.679 ' CD2' HD13 ' A' ' 57' ' ' LEU . 2.8 m-90 -150.75 136.23 17.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.172 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.757 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -76.97 114.6 15.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.11 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -125.86 151.46 46.82 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 120.749 0.309 . . . . 0.0 111.305 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.527 ' H ' ' H ' ' A' ' 76' ' ' THR . 0.3 OUTLIER -124.86 113.35 17.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.163 -179.598 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.833 HG12 HD23 ' A' ' 75' ' ' LEU . 10.5 m -71.92 122.83 25.06 Favored 'Isoleucine or valine' 0 C--N 1.338 0.07 0 CA-C-O 121.171 0.51 . . . . 0.0 110.323 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 2.1 mttt -65.26 -21.55 66.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.98 -178.12 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.815 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 5.9 m-20 -102.67 113.15 26.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.221 0.534 . . . . 0.0 111.624 -179.048 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.424 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 13.4 t80 -58.56 -38.33 77.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.237 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -103.24 23.3 12.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.548 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.815 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.1 p -42.99 148.83 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.826 -179.529 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.694 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 15.5 pm0 -73.22 141.76 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.273 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.711 ' CD1' HD11 ' A' ' 70' ' ' ILE . 36.6 mm -120.43 105.19 16.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.634 179.086 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.694 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -103.38 97.44 7.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.59 -179.241 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.659 HD11 ' HD1' ' A' ' 119' ' ' TYR . 3.3 mt -95.75 144.46 26.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.357 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 115' ' ' GLU . 2.7 p -94.06 -169.36 2.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.606 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.5 p-80 -67.55 10.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.689 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.4 mt-10 -100.88 -30.48 11.65 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.72 0.295 . . . . 0.0 110.887 179.431 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.406 ' ND1' ' HB2' ' A' ' 34' ' ' LEU . 26.1 m-70 -124.78 124.0 41.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.889 0.376 . . . . 0.0 110.942 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.734 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -82.47 -17.57 44.77 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.5 -179.932 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -163.46 -176.56 4.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.241 0.544 . . . . 0.0 111.507 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.678 ' CE2' HG13 ' A' ' 110' ' ' ILE . 31.9 p90 -153.59 172.38 17.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.325 -179.589 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -157.9 157.87 33.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.118 0.485 . . . . 0.0 111.03 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.56 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 83.5 m95 -122.31 107.06 11.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.382 178.823 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.82 165.09 26.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 0.0 111.567 -178.402 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.53 -154.14 1.21 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.819 179.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.8 tp -76.73 -43.67 36.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.836 0.35 . . . . 0.0 110.745 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -57.36 -51.63 68.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.614 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.668 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.62 -53.08 20.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.811 0.338 . . . . 0.0 110.244 -179.887 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.459 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.04 -27.41 7.93 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.525 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.442 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.5 OUTLIER -82.69 -35.25 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.511 178.392 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -63.55 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.5 -179.642 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.606 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -77.91 -39.77 41.87 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.265 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -80.03 47.8 0.92 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 179.285 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.19 -29.34 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.726 -179.861 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.458 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -59.69 119.83 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.421 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -46.46 -46.24 18.77 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.218 0.532 . . . . 0.0 111.847 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 1.009 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.1 mp0 -52.7 -56.39 15.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.893 -178.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.496 ' HA ' ' HE3' ' A' ' 136' ' ' MET . 0.0 OUTLIER -59.43 -41.0 88.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.571 0.224 . . . . 0.0 111.446 -179.347 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.59 -42.3 64.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.103 179.455 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.575 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.11 -47.62 67.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.608 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.34 -49.1 62.07 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.92 0.391 . . . . 0.0 110.206 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -74.36 -26.81 60.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.319 178.887 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.3 OUTLIER -68.06 -52.72 32.07 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.095 -179.818 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 3.1 mm-40 -68.79 -29.17 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.264 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.438 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.71 -48.46 84.83 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.854 179.379 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.457 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -74.55 -28.95 61.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.887 0.375 . . . . 0.0 110.743 179.579 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 145' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 8.1 tp60 -68.35 -51.46 44.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.481 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.564 ' CD2' HD11 ' A' ' 150' ' ' ILE . 71.0 t80 -65.43 -51.21 61.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.996 0.427 . . . . 0.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.499 ' HA ' HG13 ' A' ' 150' ' ' ILE . 93.9 mt -56.33 -32.29 64.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.899 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 4.2 t -75.98 -14.03 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.0 110.714 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.41 -9.66 23.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.784 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 146' ' ' PHE . 0.9 OUTLIER -83.4 -132.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.611 -179.99 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -147.94 -69.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.881 0.372 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -155.24 -77.45 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 179.375 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.745 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.627 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.571 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.259 -1.136 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.571 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.34 12.78 0.6 Allowed 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 124.288 3.325 . . . . 0.0 109.629 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.453 ' H ' ' C ' ' A' ' 1' ' ' GLY . 0.1 OUTLIER 61.15 90.27 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.823 -179.916 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -126.66 -36.08 0.53 Allowed Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.736 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 m -59.45 98.47 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.848 0.356 . . . . 0.0 111.271 -179.664 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.401 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -88.28 132.33 34.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.254 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.646 ' HB1' ' O ' ' A' ' 93' ' ' PRO . . . 64.21 178.16 0.17 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 111.003 -179.887 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.18 131.26 56.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.354 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -82.89 132.39 35.16 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.673 -178.907 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.681 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -145.1 163.22 34.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.507 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 56.7 m -154.52 124.31 6.65 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.029 0.443 . . . . 0.0 111.732 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.26 171.49 13.87 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.534 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -122.57 117.89 26.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.28 0.54 . . . . 0.0 112.44 -179.174 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.826 HD11 ' HB1' ' A' ' 139' ' ' ALA . 54.2 mt -80.73 92.12 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.781 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.287 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.867 HD11 HG23 ' A' ' 64' ' ' THR . 27.2 mt -84.4 146.88 6.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.706 -178.035 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.78 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.6 p90 -153.88 121.15 5.76 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.288 -179.385 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' CG ' ' HB2' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -79.74 114.42 18.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.518 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.465 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.5 OUTLIER -102.89 126.71 50.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.127 -179.112 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.78 159.23 19.8 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.435 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.67 -85.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.659 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.624 HD11 ' HE3' ' A' ' 23' ' ' LYS . 2.8 pp -115.94 148.73 41.95 Favored Pre-proline 0 C--N 1.332 -0.174 0 CA-C-O 120.654 0.264 . . . . 0.0 110.9 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.62 153.23 73.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.543 2.162 . . . . 0.0 112.541 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.624 ' HE3' HD11 ' A' ' 21' ' ' ILE . 0.7 OUTLIER -132.16 -73.44 0.52 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.336 179.964 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG12 ' O ' ' A' ' 24' ' ' VAL . 23.3 t -72.33 -7.0 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.395 -179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.25 21.05 12.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 0.0 110.885 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -88.78 -78.19 0.35 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -121.36 -167.01 1.44 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.185 179.538 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 -50.5 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.959 0.409 . . . . 0.0 111.19 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.78 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.7 mt -111.14 141.11 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.056 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.673 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.1 mt-10 -133.89 127.25 32.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.046 179.102 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.678 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -87.09 154.37 20.8 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.5 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 15' ' ' ILE . 39.2 tp -90.73 135.01 33.99 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.843 178.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 127' ' ' ALA . 5.9 mt -135.11 142.02 46.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.757 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 112' ' ' LEU . 14.5 mt -121.81 107.42 12.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HB2' ' CD2' ' A' ' 43' ' ' TRP . 37.3 tt0 -67.71 141.77 56.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.04 157.37 25.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.191 179.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.518 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 78.8 p -90.16 2.85 54.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.61 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -174.07 177.42 2.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.835 0.35 . . . . 0.0 110.93 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.31 -131.92 10.78 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.121 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 40' ' ' ILE . 12.1 tt -82.59 -2.69 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.892 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 61.61 27.67 17.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -60.43 148.9 35.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.849 0.357 . . . . 0.0 110.549 179.638 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.697 ' O ' HG23 ' A' ' 44' ' ' THR . 37.5 m95 -98.11 150.1 21.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.035 179.916 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.77 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -171.54 144.02 1.56 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.524 -179.728 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.484 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 32.8 Cg_exo -61.56 165.63 13.1 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.356 2.037 . . . . 0.0 112.171 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.12 102.07 0.2 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.484 2.123 . . . . 0.0 112.443 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -87.92 155.44 19.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.907 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.511 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -138.13 174.29 22.0 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.206 179.828 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -115.81 103.53 10.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.677 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.666 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -81.3 127.37 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.302 0.572 . . . . 0.0 111.363 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.0 tt0 -88.46 153.24 50.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.291 179.968 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 12.5 Cg_endo -55.57 -18.74 21.07 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.985 2.456 . . . . 0.0 112.585 -179.525 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.632 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -107.54 -6.67 32.99 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.926 179.213 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -88.75 176.48 7.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.925 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -92.7 161.41 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.029 0.442 . . . . 0.0 109.991 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 24.3 m-20 -73.7 -61.06 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.849 -179.099 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.652 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 36.6 tp -65.91 -40.01 91.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.74 0.305 . . . . 0.0 110.831 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.925 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.15 -47.15 54.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.79 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.666 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.1 m -58.0 -43.6 86.72 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -69.94 -32.7 71.11 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.019 178.755 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.2 mt -71.11 -51.77 23.18 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.491 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.2 OUTLIER -61.78 -41.03 97.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.011 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.22 -34.78 77.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.163 0.506 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.867 HG23 HD11 ' A' ' 15' ' ' ILE . 93.5 m -60.08 -51.39 69.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.434 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.535 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.0 pt20 -76.85 -21.81 54.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.515 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -78.27 -35.03 48.59 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.304 . . . . 0.0 110.73 179.193 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 2.0 mp0 -108.18 -14.24 14.75 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.5 -8.79 4.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.691 0.281 . . . . 0.0 111.632 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.973 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.54 -8.65 25.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.236 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.795 HG23 ' HG2' ' A' ' 74' ' ' GLN . 3.2 mt -94.22 123.4 46.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.012 -179.677 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pm0 -103.54 169.38 8.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.023 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.929 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -45.89 -39.13 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.364 179.719 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.95 -23.02 74.32 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.382 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.795 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -95.76 1.39 53.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.726 0.298 . . . . 0.0 111.324 -179.994 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -137.69 -166.41 1.95 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.692 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -140.57 98.52 3.43 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.57 HG13 HD21 ' A' ' 61' ' ' LEU . 9.4 mm -73.24 114.2 12.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.074 0.464 . . . . 0.0 111.778 -179.848 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.667 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -77.05 138.13 21.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.62 179.322 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -97.52 148.82 22.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.403 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.93 -24.64 27.7 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.12 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.674 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 12.1 t80 -104.35 127.43 52.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.836 0.35 . . . . 0.0 111.146 -179.842 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.521 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -158.94 128.19 5.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.261 0.553 . . . . 0.0 111.31 179.577 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.4 tpt85 -154.53 137.86 15.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.95 179.294 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.844 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -120.83 136.13 54.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.169 0.509 . . . . 0.0 111.455 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.96 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.6 mt -95.24 118.21 31.61 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.168 179.163 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -108.34 126.3 52.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.735 -179.261 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.588 ' CE2' ' C6 ' ' A' ' 154' ' ' ATP . 7.4 p90 -167.0 141.0 3.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 -179.633 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.661 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.9 p -80.7 113.57 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.53 0.681 . . . . 0.0 110.64 179.294 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.752 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -68.61 -102.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.352 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.432 ' HB3' HH11 ' A' ' 90' ' ' ARG . 0.0 OUTLIER -77.48 -35.01 54.14 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 120.964 0.412 . . . . 0.0 110.312 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -172.89 16.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.603 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.819 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -148.6 126.38 5.76 Favored Pre-proline 0 N--CA 1.451 -0.384 0 CA-C-O 120.945 0.402 . . . . 0.0 111.365 -179.616 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.836 ' O ' HD12 ' A' ' 8' ' ' LEU . 50.6 Cg_endo -69.06 118.71 5.84 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.615 2.877 . . . . 0.0 113.234 -179.52 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 4.6 mmmt -101.39 124.76 47.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.331 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 27.2 m -89.4 114.93 26.45 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.719 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 37.5 t -113.52 108.03 24.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.759 -178.808 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.844 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.35 132.5 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.695 ' HB3' HG13 ' A' ' 14' ' ' ILE . 43.0 m-85 -118.66 129.97 55.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.126 0.488 . . . . 0.0 111.656 -178.91 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.652 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 1.1 m-90 -118.47 142.62 47.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.387 179.47 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 HG21 ' A' ' 78' ' ' ILE . 1.5 mt -76.07 123.09 25.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -133.85 134.39 42.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.441 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.63 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.4 tt0 -114.78 115.15 26.56 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.182 -179.533 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.804 HG12 HD23 ' A' ' 75' ' ' LEU . 16.6 m -72.05 108.29 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-O 121.547 0.689 . . . . 0.0 110.143 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -57.07 -13.04 2.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.974 -178.774 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.2 t0 -107.87 116.6 32.24 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.012 0.434 . . . . 0.0 111.347 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -65.59 -38.96 90.99 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.323 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.39 25.74 6.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.511 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.1 p -51.37 146.33 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.87 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.1 pm0 -74.12 145.84 44.01 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.065 -179.357 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.794 HD13 HD11 ' A' ' 70' ' ' ILE . 32.7 mm -122.47 101.22 9.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.951 179.389 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.973 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -102.11 97.03 7.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.095 -179.468 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 34' ' ' LEU . 6.1 mt -90.03 150.53 22.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.801 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.2 t -83.86 -168.13 2.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.09 1.58 10.79 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.552 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -98.83 -29.14 13.14 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.591 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.6 m80 -109.11 110.81 22.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.769 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.518 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 12.9 pt20 -89.53 -6.73 56.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.842 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -170.61 152.62 3.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.107 0.48 . . . . 0.0 111.838 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.725 ' CE2' HG13 ' A' ' 110' ' ' ILE . 32.7 p90 -133.23 175.81 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.306 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.607 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -157.54 166.32 33.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.368 0.604 . . . . 0.0 111.798 179.801 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.407 ' CE3' ' HG2' ' A' ' 17' ' ' ARG . 83.5 m95 -131.01 106.75 8.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.335 178.751 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.761 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -137.38 170.17 16.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.205 0.526 . . . . 0.0 111.518 -178.441 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.71 -153.26 3.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.706 179.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 128' ' ' CYS . 8.5 tp -77.23 -41.26 41.9 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.989 0.423 . . . . 0.0 111.264 179.724 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.6 pt-20 -61.25 -50.93 71.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.488 -179.566 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.761 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -71.65 -40.57 69.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.403 -179.347 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.648 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -62.25 -32.42 73.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.8 m -82.19 -31.13 30.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.569 179.162 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 1.2 pp0? -67.23 -44.75 78.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.011 -179.64 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.624 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.8 mt -74.71 -46.19 39.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.923 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.429 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -77.66 51.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.296 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.476 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.18 -26.99 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.88 -179.326 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.653 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.2 m-85 -61.03 119.43 8.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.413 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.448 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 0.1 OUTLIER -44.89 -46.75 11.06 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.078 0.466 . . . . 0.0 111.87 -179.02 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.96 ' HB3' HD13 ' A' ' 85' ' ' LEU . 13.1 mp0 -52.46 -54.49 31.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.827 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.77 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.61 -41.37 98.94 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -178.595 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -55.77 -34.49 65.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.685 0.278 . . . . 0.0 110.344 179.729 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.79 -43.75 53.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.471 179.544 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.826 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.41 -45.54 80.62 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.302 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.648 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.5 OUTLIER -75.58 -26.41 57.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.991 178.138 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.514 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.1 OUTLIER -68.4 -52.06 37.15 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.31 0.576 . . . . 0.0 110.533 179.867 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.674 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 4.5 mm-40 -69.9 -28.99 66.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.861 -179.594 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -58.29 -47.98 86.33 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.313 179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.491 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.9 OUTLIER -75.21 -33.08 61.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.984 0.421 . . . . 0.0 110.342 179.587 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 145' ' ' GLN . . . . . 0.423 ' OE1' ' HA ' ' A' ' 145' ' ' GLN . 4.4 tp60 -63.31 -51.88 64.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.716 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -61.93 -50.48 71.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.739 179.815 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.595 ' HA ' ' CD1' ' A' ' 150' ' ' ILE . 69.9 mt -59.48 -34.11 72.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.1 t -74.02 -20.02 60.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.724 179.36 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.19 -10.49 41.51 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.937 -179.846 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.595 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 0.2 OUTLIER -86.86 -130.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.166 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -178.05 -78.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.73 0.3 . . . . 0.0 110.816 179.611 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.42 156.81 36.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.913 0.387 . . . . 0.0 110.968 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 153' ' ' LEU . 9.5 mt . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.741 179.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.752 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.521 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -72.44 101.52 1.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 124.328 3.352 . . . . 0.0 109.555 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.9 -40.69 3.11 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.982 0.42 . . . . 0.0 110.657 -179.948 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.19 -83.16 0.35 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.491 179.881 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 m -83.13 102.58 11.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.783 0.325 . . . . 0.0 110.918 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.405 ' CE ' ' HB2' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -72.61 126.66 30.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.667 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.668 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 57.82 168.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.381 0.61 . . . . 0.0 111.49 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.075 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.39 138.87 45.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.52 179.801 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.8 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.1 OUTLIER -79.11 128.52 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.984 -179.981 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.82 161.07 39.6 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 20.8 m -157.14 123.47 4.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.162 0.506 . . . . 0.0 111.212 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.534 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.49 170.85 13.66 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.483 178.79 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.467 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -122.73 118.15 27.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.049 0.425 . . . . 0.0 111.669 -179.42 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.778 HD11 ' HB1' ' A' ' 139' ' ' ALA . 56.1 mt -83.01 91.22 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.432 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.128 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.004 HD11 HG23 ' A' ' 64' ' ' THR . 29.6 mt -81.15 145.29 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.049 -178.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.713 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 46.2 p90 -151.91 121.19 6.77 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.016 -178.866 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.469 ' CD ' ' HA ' ' A' ' 106' ' ' TYR . 8.9 ttp180 -76.67 118.02 18.88 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.3 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.617 HH11 ' HB2' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -93.59 116.24 28.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.946 -178.378 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.83 160.64 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.488 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 tp -68.77 -85.51 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.163 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.45 ' H ' HG13 ' A' ' 21' ' ' ILE . 2.7 pp -112.26 158.49 36.95 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.7 0.286 . . . . 0.0 111.619 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.09 147.9 51.27 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.657 2.238 . . . . 0.0 112.105 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -79.2 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.665 179.966 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.4 m -133.12 -41.43 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.269 0.556 . . . . 0.0 110.931 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 176.24 32.82 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.628 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.41 -77.98 0.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.013 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -175.93 -178.85 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.834 179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.14 -53.41 2.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.07 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.713 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.3 mt -107.61 154.9 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.114 0.483 . . . . 0.0 111.772 -179.626 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.612 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.5 mp0 -138.37 127.32 23.94 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.121 179.659 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.649 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 55.2 m-85 -91.35 146.68 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.955 0.407 . . . . 0.0 112.036 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.646 HD23 HD12 ' A' ' 15' ' ' ILE . 43.5 tp -81.88 132.68 35.28 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.652 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.499 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.5 mt -133.14 142.74 48.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.968 0.413 . . . . 0.0 110.791 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 112' ' ' LEU . 17.2 mt -121.81 104.2 9.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.535 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.1 tt0 -64.56 134.07 53.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.271 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.43 139.56 55.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.599 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.765 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 69.3 p -77.6 12.18 1.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.742 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -179.21 -171.5 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.659 0.266 . . . . 0.0 110.455 179.661 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.89 -122.98 5.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.245 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.802 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -96.76 8.7 6.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.641 0.258 . . . . 0.0 111.343 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.8 36.82 15.94 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.337 0.589 . . . . 0.0 109.911 -178.973 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.802 ' HB3' HD11 ' A' ' 40' ' ' ILE . 3.8 p-80 -79.35 155.2 28.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.211 -179.555 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.595 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.6 m95 -104.59 137.9 41.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.296 -179.76 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.7 OUTLIER -160.5 136.68 6.23 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.985 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.02 178.78 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.405 2.07 . . . . 0.0 111.656 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HG3' HD11 ' A' ' 34' ' ' LEU . 50.9 Cg_exo -56.31 98.12 0.07 OUTLIER 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.437 2.091 . . . . 0.0 112.644 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -97.97 129.31 44.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.773 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -146.47 140.74 8.97 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.701 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 14.2 p-80 -76.29 127.23 32.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.663 0.268 . . . . 0.0 110.798 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.8 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -88.72 137.32 21.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.984 0.421 . . . . 0.0 110.582 179.634 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.666 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 3.0 tt0 -89.72 152.12 46.48 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.4 Cg_endo -55.25 -22.91 34.7 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.524 2.149 . . . . 0.0 112.971 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.666 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.42 -11.83 43.57 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.383 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -88.05 158.64 18.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.603 0.24 . . . . 0.0 110.63 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.915 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 16.8 t0 -77.73 163.42 26.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.995 0.426 . . . . 0.0 110.22 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.87 -61.37 1.79 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.649 HD21 HG21 ' A' ' 77' ' ' ILE . 22.0 tp -64.32 -41.7 96.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.145 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.915 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 2.1 mt-10 -51.19 -45.15 61.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.687 -179.545 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.584 HG21 ' HB ' ' A' ' 50' ' ' VAL . 82.4 m -58.21 -40.91 82.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.149 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -72.49 -30.62 64.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.905 178.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.0 mt -72.62 -52.47 15.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.421 179.349 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.48 -41.02 96.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.804 -179.659 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 46' ' ' PRO . . . -60.45 -33.64 72.86 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.147 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 64' ' ' THR . . . . . 1.004 HG23 HD11 ' A' ' 15' ' ' ILE . 24.5 m -60.14 -58.26 9.28 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.412 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.484 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -70.18 -20.31 63.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.621 179.47 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.4 tm-20 -79.06 -39.86 32.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.125 179.666 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.414 ' O ' ' CD2' ' A' ' 112' ' ' LEU . 10.3 mm-40 -106.38 -5.3 19.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.934 -179.309 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.46 -11.76 1.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.525 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.687 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.38 -3.85 51.9 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.857 -1.164 . . . . 0.0 112.85 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.789 HD11 ' CD1' ' A' ' 110' ' ' ILE . 5.0 mt -99.01 121.79 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.53 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 pm0 -105.11 171.06 7.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.523 0.202 . . . . 0.0 111.208 -179.387 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.93 -31.7 7.78 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.698 179.921 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.89 -23.85 75.46 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.317 -0.944 . . . . 0.0 111.857 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.548 ' HB3' HG23 ' A' ' 70' ' ' ILE . 2.5 tp60 -95.03 3.85 54.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 0.0 110.921 179.655 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.897 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.48 -169.25 2.83 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.289 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -137.23 100.3 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.364 -179.671 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.649 HG21 HD21 ' A' ' 57' ' ' LEU . 10.1 mm -71.59 126.92 32.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.96 179.74 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.535 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -90.02 137.69 20.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.062 0.458 . . . . 0.0 111.07 -179.937 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -97.85 149.95 21.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.397 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.21 -27.1 21.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.352 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.896 ' CD1' HD21 ' A' ' 100' ' ' LEU . 15.0 t80 -105.03 126.02 51.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.733 0.301 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.57 124.56 5.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.257 0.551 . . . . 0.0 111.524 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.76 140.71 21.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.464 179.053 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.959 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.0 pm0 -121.19 138.26 54.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.05 0.452 . . . . 0.0 111.771 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.797 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -98.87 116.91 32.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.622 179.457 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 0.3 OUTLIER -113.86 125.66 54.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.5 -179.995 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 10.1 p90 -166.67 146.25 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.572 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.9 p -82.37 110.71 17.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.332 179.561 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.844 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -80.78 -95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.627 -179.066 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.472 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -67.28 -41.17 85.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.872 0.368 . . . . 0.0 110.655 -179.923 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.499 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER 178.12 26.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.278 179.766 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.81 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.48 129.94 4.24 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.447 179.591 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.911 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.5 Cg_endo -70.07 119.58 6.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.208 2.605 . . . . 0.0 112.998 -179.195 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 1.075 ' HG2' HD13 ' A' ' 8' ' ' LEU . 7.4 mmmt -104.3 121.9 44.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.047 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.457 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.0 m -87.94 116.81 26.37 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.619 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.1 t -115.81 108.9 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.859 -178.114 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.959 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.6 mm -86.0 126.63 40.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.374 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.636 ' HB3' HG13 ' A' ' 14' ' ' ILE . 13.8 m-85 -113.27 133.25 55.2 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.085 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.636 ' CD2' HD13 ' A' ' 57' ' ' LEU . 9.3 m-90 -117.83 141.43 48.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.949 178.566 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.896 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -78.07 115.65 17.96 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.791 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.601 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -124.55 144.4 50.15 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.16 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.458 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.3 tt0 -123.1 116.38 23.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.81 0.338 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.733 HG12 HD23 ' A' ' 75' ' ' LEU . 11.2 m -73.22 115.01 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.431 0.634 . . . . 0.0 110.705 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.532 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.17 -11.95 17.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.607 -179.188 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.812 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 66.9 t0 -114.12 121.55 44.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.619 179.278 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.469 ' HA ' ' CD ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -70.59 -47.47 60.01 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.581 0.705 . . . . 0.0 109.456 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -85.03 16.49 3.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.057 178.491 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.812 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.8 p -46.14 144.53 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.153 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.101 179.909 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.6 OUTLIER -66.82 143.95 56.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 111.755 -179.033 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.866 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.0 mm -123.45 99.8 7.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.81 -1.087 . . . . 0.0 110.222 179.37 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.687 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 23.8 mtp180 -102.13 103.08 13.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.332 -178.658 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 34' ' ' LEU . 11.3 mt -98.85 135.6 40.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -164.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.113 179.343 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 14.4 0.92 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 179.681 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.62 -36.15 7.58 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.843 0.354 . . . . 0.0 110.886 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.407 ' CD2' ' HB3' ' A' ' 67' ' ' GLU . 75.3 m-70 -113.31 115.68 28.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.607 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.765 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 1.6 pt20 -86.93 -14.36 42.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.827 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -160.05 153.11 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.07 0.462 . . . . 0.0 112.131 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.866 ' CD1' HG21 ' A' ' 110' ' ' ILE . 45.0 p90 -133.19 171.41 14.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.168 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.42 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 3.6 mtt180 -157.37 160.3 38.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.213 0.53 . . . . 0.0 111.846 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.2 m95 -124.21 107.67 11.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.791 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.47 168.49 19.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.942 -178.303 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.73 -153.94 2.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.998 179.59 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 141' ' ' GLN . 12.4 tp -77.33 -41.6 39.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.828 0.347 . . . . 0.0 111.119 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.6 pt-20 -61.43 -50.23 73.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.619 -179.449 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.833 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.93 -45.8 63.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.87 0.366 . . . . 0.0 110.531 -179.47 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.499 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -56.89 -30.46 63.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 109.802 179.174 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.7 m -84.38 -31.98 24.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.271 178.634 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.833 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.01 -43.79 91.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.872 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.647 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.1 mt -77.72 -42.55 33.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.954 179.281 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.2 53.5 1.24 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.589 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.14 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 114.885 -1.052 . . . . 0.0 111.876 -178.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.538 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 40.9 m-85 -59.74 120.75 10.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.308 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -46.32 -52.27 13.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.301 0.572 . . . . 0.0 111.26 -179.453 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.797 ' HB3' HD13 ' A' ' 85' ' ' LEU . 15.9 mp0 -43.6 -54.39 4.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.829 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.667 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -66.39 -34.06 77.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.872 0.368 . . . . 0.0 110.584 -179.498 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.91 -35.32 74.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.408 179.545 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.42 -45.29 22.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.794 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.778 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.84 -55.38 23.48 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.114 179.487 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.667 HD12 ' O ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -63.8 -27.56 69.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.455 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.529 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.4 OUTLIER -68.99 -51.77 35.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.029 -179.9 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.588 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 71.1 mm-40 -71.26 -30.96 66.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.32 -47.63 88.45 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.651 179.105 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.506 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 29.8 t-80 -74.58 -31.69 62.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.803 0.335 . . . . 0.0 110.435 179.192 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.68 -53.2 51.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.348 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.16 -48.9 78.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.747 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.719 HD23 HD11 ' A' ' 150' ' ' ILE . 79.3 mt -60.91 -26.99 67.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.532 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 148' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.7 t -76.04 -17.13 59.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.782 0.325 . . . . 0.0 110.792 179.443 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 m -92.46 -12.49 31.93 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.598 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.719 HD11 HD23 ' A' ' 147' ' ' LEU . 0.0 OUTLIER -91.29 -133.72 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 179.808 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 151' ' ' GLU . . . . . 0.482 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 1.0 OUTLIER -165.28 -72.63 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.956 0.408 . . . . 0.0 110.136 179.698 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 53.34 17.01 0.96 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.525 . . . . 0.0 112.186 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.834 -0.167 . . . . 0.0 111.033 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.844 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.764 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.507 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.764 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 82.4 Cg_endo -72.36 24.88 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 124.328 3.352 . . . . 0.0 109.619 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 1' ' ' GLY . 2.8 mp -115.87 16.22 16.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.309 -179.847 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.85 93.45 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.516 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.96 158.78 27.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 0.0 110.887 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.46 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 2.3 ptm -168.61 -178.36 3.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.753 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 69.54 172.52 0.3 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.062 0.458 . . . . 0.0 111.351 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.801 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -118.22 137.19 53.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.309 179.565 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.867 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.65 115.74 24.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.146 -179.665 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -126.84 174.59 8.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.679 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -164.04 124.91 2.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.164 0.507 . . . . 0.0 111.186 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.672 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.94 175.88 15.9 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.789 HD11 HD23 ' A' ' 61' ' ' LEU . 1.2 mt -128.99 119.4 24.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.466 0.633 . . . . 0.0 112.693 -178.936 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.572 HD11 ' HB3' ' A' ' 98' ' ' TYR . 14.2 mm -77.0 91.61 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.225 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.987 HD11 HG23 ' A' ' 64' ' ' THR . 58.7 mt -88.01 141.83 13.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.601 -178.287 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.814 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 54.8 p90 -152.23 122.42 7.16 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -179.116 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 ptt85 -83.69 114.31 21.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.251 179.31 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -101.62 112.36 24.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.95 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 160.32 8.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.9 mt -46.62 -56.4 6.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.73 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -152.1 154.25 32.22 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.031 179.419 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.48 ' O ' ' HE2' ' A' ' 23' ' ' LYS . 28.0 Cg_exo -61.88 156.94 45.88 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.697 2.265 . . . . 0.0 112.18 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HE2' ' O ' ' A' ' 22' ' ' PRO . 1.7 mmpt? -132.33 -81.19 0.5 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.759 0.314 . . . . 0.0 111.163 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 24' ' ' VAL . 19.9 t -93.66 -3.87 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.623 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.83 32.8 5.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.916 0.389 . . . . 0.0 110.822 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -89.54 -68.59 0.77 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.138 -179.714 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -145.08 98.58 3.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.691 179.659 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -86.94 -47.75 8.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.668 -179.116 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.824 ' HB ' ' HE2' ' A' ' 144' ' ' HIS . 4.1 mt -106.29 143.54 17.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.113 -179.05 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.751 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.6 OUTLIER -137.28 132.94 34.43 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.244 179.45 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.66 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 45.0 m-85 -94.75 143.52 26.38 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.072 0.463 . . . . 0.0 112.233 -178.682 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.652 HD21 ' CB ' ' A' ' 68' ' ' ALA . 50.0 tp -79.59 132.87 36.39 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.339 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.572 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.7 mt -135.04 140.71 45.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.648 179.833 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 112' ' ' LEU . 8.7 mt -117.86 123.79 46.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 -178.987 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.495 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 1.2 tt0 -68.59 151.71 46.36 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.135 -179.414 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 37' ' ' SER . . . -83.24 -12.11 57.11 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.873 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 44.4 t 72.22 -60.17 0.54 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.477 0.18 . . . . 0.0 111.306 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -110.8 -174.49 2.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.836 0.351 . . . . 0.0 110.896 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.3 -132.73 33.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.287 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 40' ' ' ILE . 9.3 tt -82.29 1.02 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-O 120.648 0.261 . . . . 0.0 111.434 -179.897 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 61.33 24.11 14.26 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.787 0.327 . . . . 0.0 111.162 179.523 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -60.38 148.14 38.24 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.884 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.507 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 26.8 m95 -103.05 110.31 22.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.386 179.733 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.644 ' HB ' ' HE2' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -126.91 128.47 24.21 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.778 -179.323 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.573 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 49.2 Cg_exo -55.9 168.18 1.93 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.326 2.017 . . . . 0.0 112.493 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.65 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 15.2 Cg_endo -59.79 101.04 0.14 Allowed 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 123.148 2.565 . . . . 0.0 112.875 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE2' ' HB ' ' A' ' 44' ' ' THR . 4.7 mtmt -103.52 129.57 50.73 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.852 0.358 . . . . 0.0 111.093 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.55 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.13 -179.37 20.25 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.345 179.744 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -120.02 104.84 10.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 110.69 179.692 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.867 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -76.2 129.04 37.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.042 0.449 . . . . 0.0 111.193 -179.138 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.667 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -92.4 177.01 2.28 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.539 -179.596 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.667 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.0 Cg_exo -57.42 -60.25 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.684 2.256 . . . . 0.0 112.72 -178.992 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.54 0.13 88.41 Favored Glycine 0 CA--C 1.517 0.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.694 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.606 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 17.6 tt0 -78.73 171.98 14.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.35 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.4 t70 -98.6 158.69 15.44 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.208 0.527 . . . . 0.0 110.056 178.896 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.556 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.755 -179.074 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' CD2' ' A' ' 99' ' ' TRP . 33.1 tp -65.2 -39.04 92.3 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.668 0.27 . . . . 0.0 111.223 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.998 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -49.1 -45.38 43.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.665 179.675 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.551 HG21 ' N ' ' A' ' 50' ' ' VAL . 66.6 m -59.83 -48.62 80.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.33 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -64.64 -28.02 69.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.158 178.694 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.2 mt -76.35 -51.67 11.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.25 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -63.08 -35.18 79.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.55 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.72 -38.23 88.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.269 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.987 HG23 HD11 ' A' ' 15' ' ' ILE . 56.2 m -56.15 -51.21 68.8 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.593 179.133 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.471 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.3 pt20 -76.03 -21.97 56.26 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.961 179.622 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 0.9 OUTLIER -75.9 -35.89 59.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.214 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.65 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 2.8 mm-40 -112.04 -4.99 14.33 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.652 ' CB ' HD21 ' A' ' 32' ' ' LEU . . . -136.92 -6.65 1.87 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 179.697 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.548 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 72.94 -7.73 9.11 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.219 -0.991 . . . . 0.0 113.804 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.737 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.0 OUTLIER -96.6 129.14 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.005 0.431 . . . . 0.0 111.161 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.9 pt-20 -110.63 170.2 8.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 -179.682 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.13 -36.3 5.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.156 179.452 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.87 -24.04 74.27 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.53 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.493 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.8 mm100 -97.1 -4.04 40.14 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.676 -0.308 . . . . 0.0 111.485 -179.673 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.59 -170.93 2.48 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.898 0.38 . . . . 0.0 110.257 178.128 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.569 ' H ' ' H ' ' A' ' 102' ' ' GLU . 34.6 m -133.65 100.06 4.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.605 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.603 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 12.2 mm -72.26 113.11 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.732 -179.608 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.766 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.2 mp -73.49 144.95 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.845 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -100.17 148.96 24.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.205 -179.65 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.1 -17.44 57.09 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.714 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.512 ' CD2' HD11 ' A' ' 100' ' ' LEU . 30.5 t80 -100.3 102.45 13.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -126.02 135.59 51.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.004 0.431 . . . . 0.0 110.42 179.366 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -163.56 145.93 9.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.574 179.962 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.924 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -136.15 116.43 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.983 0.421 . . . . 0.0 111.908 179.88 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.92 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.9 mt -77.73 119.17 20.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.956 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -112.82 119.98 39.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.862 -179.281 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 7.8 p90 -167.28 144.34 4.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.258 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.628 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.2 p -81.84 115.38 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.416 0.627 . . . . 0.0 110.387 179.156 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.764 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -72.72 -98.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.938 -178.309 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB2' HH11 ' A' ' 90' ' ' ARG . 0.0 OUTLIER -78.39 -35.55 47.09 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.099 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.564 ' O ' ' HE2' ' A' ' 92' ' ' LYS . 1.1 m-20 -174.6 18.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.359 179.616 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.801 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -150.77 128.39 5.67 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-O 120.992 0.425 . . . . 0.0 110.883 -179.94 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.735 ' O ' HD12 ' A' ' 8' ' ' LEU . 60.3 Cg_endo -74.09 118.32 5.35 Favored 'Trans proline' 0 CA--C 1.509 -0.768 0 C-N-CA 123.397 2.732 . . . . 0.0 112.973 -179.293 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.5 ttpt -101.53 121.82 42.68 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.168 -179.373 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.1 m -86.69 108.06 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 178.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.71 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 30.0 t -105.92 108.19 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.706 -178.591 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.924 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.92 124.75 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.31 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.572 ' HB3' HD11 ' A' ' 14' ' ' ILE . 35.9 m-85 -110.72 130.83 55.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.847 -178.203 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CD2' HD13 ' A' ' 57' ' ' LEU . 6.3 m-90 -116.49 150.54 37.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.783 178.43 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 26.2 mt -78.89 132.88 36.94 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -139.98 140.96 36.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.994 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.569 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.4 tt0 -123.91 113.43 18.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.751 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.831 HG12 HD23 ' A' ' 75' ' ' LEU . 17.1 m -72.21 110.23 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 121.416 0.627 . . . . 0.0 110.396 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -58.56 -13.48 5.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.918 -179.038 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 65.0 t0 -108.26 114.76 28.88 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.025 0.441 . . . . 0.0 111.526 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 106' ' ' TYR . . . . . 0.42 ' CE1' ' CD ' ' A' ' 17' ' ' ARG . 0.5 OUTLIER -61.91 -42.54 99.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.121 179.357 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -96.58 25.23 5.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.103 179.014 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.7 p -49.33 147.28 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.347 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.444 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.7 pm0 -72.43 142.73 48.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.321 0.581 . . . . 0.0 110.822 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.858 HG21 ' CG ' ' A' ' 119' ' ' TYR . 44.4 mm -121.48 98.69 6.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.548 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.99 101.89 13.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.531 -179.169 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 34' ' ' LEU . 4.5 mt -92.07 160.81 15.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.016 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.21 -170.82 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.649 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -66.34 -34.67 78.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.324 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.19 -6.4 49.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.591 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.582 ' CB ' ' HB3' ' A' ' 112' ' ' LEU . 3.1 m-70 -110.93 127.86 55.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 111.131 -179.671 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -99.41 -23.2 15.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.068 179.892 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.4 -177.57 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 111.956 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.858 ' CG ' HG21 ' A' ' 110' ' ' ILE . 40.7 p90 -147.44 169.51 19.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.186 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 96.5 mtt180 -153.89 154.72 34.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.236 0.541 . . . . 0.0 111.63 -179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -119.31 107.06 12.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.468 178.698 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.72 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.28 169.31 18.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.102 0.477 . . . . 0.0 111.632 -178.144 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.42 -154.05 1.58 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.731 179.499 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.0 tp -76.79 -42.55 40.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.864 0.364 . . . . 0.0 111.359 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.8 pt-20 -63.08 -47.16 84.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.819 -179.268 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.732 ' O ' HD12 ' A' ' 130' ' ' LEU . 0.3 OUTLIER -74.54 -38.83 62.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.941 0.401 . . . . 0.0 110.544 -179.741 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.689 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -64.29 -29.52 70.61 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.496 0.665 . . . . 0.0 109.209 178.465 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.426 ' SG ' ' HG3' ' A' ' 137' ' ' LYS . 43.9 m -84.01 -36.35 23.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.611 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.8 OUTLIER -59.35 -44.79 92.63 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.742 -179.95 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -75.85 -39.69 56.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.701 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.494 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.9 52.59 1.26 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.176 178.082 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 132' ' ' GLN . . . . . 0.414 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.92 -31.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.59 -178.815 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.72 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 25.5 m-85 -63.18 121.29 13.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.705 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 134' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 137' ' ' LYS . 9.3 tttt -46.48 -54.31 9.5 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.158 0.504 . . . . 0.0 111.853 -179.494 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.92 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.0 mp0 -41.29 -54.92 2.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.1 -179.24 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.682 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.23 -30.92 71.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.331 . . . . 0.0 110.613 179.875 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -58.07 -36.58 73.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.899 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -76.99 -46.95 22.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.215 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -50.81 -50.82 55.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.074 0.464 . . . . 0.0 110.209 179.724 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.689 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.8 OUTLIER -72.15 -32.01 66.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.994 178.798 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.74 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.2 OUTLIER -59.06 -51.99 67.66 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.893 -179.753 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' HE2' ' A' ' 81' ' ' PHE . 1.5 mt-10 -69.57 -27.6 65.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.366 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.91 -48.62 65.92 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.916 179.42 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' HIS . . . . . 0.824 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.6 OUTLIER -80.7 -32.72 35.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.078 0.466 . . . . 0.0 110.325 179.551 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 145' ' ' GLN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 11.6 tp-100 -65.96 -52.62 48.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.972 -179.636 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.652 ' CE1' HD11 ' A' ' 150' ' ' ILE . 24.1 t80 -61.63 -53.48 55.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.622 -179.806 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.514 HD23 ' CD1' ' A' ' 150' ' ' ILE . 92.8 mt -57.61 -29.94 64.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.463 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -24.46 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.546 179.549 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -12.03 49.11 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.24 -179.774 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.652 HD11 ' CE1' ' A' ' 146' ' ' PHE . 1.2 mt -87.25 -128.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -150.21 -66.13 0.2 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.798 0.333 . . . . 0.0 110.776 179.977 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -170.09 109.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.746 ' HB3' HD11 ' A' ' 78' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.956 -179.924 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.764 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.41 -24.99 18.72 Favored 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 124.314 3.343 . . . . 0.0 109.593 -179.915 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.3 mt -123.79 -69.94 0.79 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.891 0.377 . . . . 0.0 111.012 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.78 -85.31 0.19 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.611 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.69 137.62 52.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 110.966 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.512 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -91.0 128.32 36.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.938 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 78.58 165.95 0.21 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.474 179.461 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.048 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.6 131.58 54.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.282 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.757 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtm180 -81.89 128.35 33.95 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.836 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.32 156.27 44.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.852 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.556 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 56.9 m -149.3 124.06 9.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.002 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.66 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.44 168.91 13.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.672 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.79 HD11 HD23 ' A' ' 61' ' ' LEU . 1.5 mt -118.99 117.68 29.44 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.833 -179.094 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.978 HD11 ' HB1' ' A' ' 139' ' ' ALA . 38.7 mt -82.18 92.37 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 27.7 mt -86.39 145.57 7.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.783 -177.881 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.832 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.3 p90 -150.83 123.67 8.64 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -178.967 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.545 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -82.1 112.53 19.23 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HD3' HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -103.91 120.2 40.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.046 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.36 159.26 19.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.478 179.6 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.1 tp -60.88 -80.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.986 -179.809 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.471 HD12 ' O ' ' A' ' 21' ' ' ILE . 2.8 pp -109.04 149.75 40.05 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.046 179.898 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 16.5 Cg_exo -67.29 152.51 79.19 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.571 2.181 . . . . 0.0 112.187 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.35 -76.15 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.701 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.455 HG12 ' O ' ' A' ' 24' ' ' VAL . 18.8 t -99.58 -1.62 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.232 179.692 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.5 t70 63.54 40.84 7.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.143 0.497 . . . . 0.0 110.307 -179.771 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.95 -46.0 4.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.179 -179.499 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -160.54 116.92 2.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -92.63 -51.34 5.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.642 -179.506 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ILE . . . . . 0.832 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.9 mt -98.64 147.26 7.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.205 0.526 . . . . 0.0 112.143 -178.839 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.654 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.9 mt-10 -138.92 124.68 19.7 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.776 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.693 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.1 m-85 -88.76 147.1 24.64 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.657 HD13 ' CE2' ' A' ' 121' ' ' TRP . 45.5 tp -85.87 132.62 34.06 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.843 178.828 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.51 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 4.4 mt -133.03 144.55 50.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.878 0.37 . . . . 0.0 110.757 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.677 HD11 ' HG3' ' A' ' 46' ' ' PRO . 63.4 mt -123.31 106.71 10.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.052 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -60.02 139.05 57.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.27 135.48 50.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.504 179.347 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.618 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 92.5 p -81.04 20.91 0.75 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.376 179.967 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -179.42 -173.05 0.25 Allowed 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.102 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.89 -135.65 18.31 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.323 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.543 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.1 pt -87.57 9.99 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 0.4 OUTLIER 66.45 38.46 4.26 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.533 0.683 . . . . 0.0 109.637 -179.103 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 42' ' ' HIS . . . . . 0.752 ' HE2' H5'1 ' A' ' 154' ' ' ATP . 1.8 p-80 -85.82 152.99 22.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.922 -179.587 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.654 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 54.9 m95 -100.05 157.94 16.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.093 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.6 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -173.19 130.62 0.57 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.221 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 75.0 Cg_exo -50.99 169.12 0.19 Allowed 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.025 1.817 . . . . 0.0 112.091 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' PRO . . . . . 0.864 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 16.5 Cg_exo -64.25 81.14 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.492 2.128 . . . . 0.0 111.847 179.606 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -104.55 151.92 23.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.133 -179.786 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.536 ' O ' ' HB1' ' A' ' 10' ' ' ALA . . . -134.65 -172.69 12.87 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.592 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 49' ' ' HIS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 9.4 p-80 -109.74 110.82 21.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.713 0.292 . . . . 0.0 110.456 179.636 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.757 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.8 p -79.71 132.97 30.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.507 0.67 . . . . 0.0 111.135 -179.083 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.773 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.9 tt0 -91.03 152.79 44.6 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.516 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 19.6 Cg_endo -57.17 -15.86 19.65 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.647 2.231 . . . . 0.0 112.525 -179.292 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.773 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -106.23 -11.44 27.63 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 178.982 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -87.83 170.92 10.77 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ASP . . . . . 0.977 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -87.52 162.08 17.42 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ASP . . . . . 0.513 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 9.6 m-20 -73.91 -63.5 1.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.864 -179.368 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.588 HD21 HG21 ' A' ' 77' ' ' ILE . 23.3 tp -64.63 -39.06 93.03 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.685 0.279 . . . . 0.0 110.639 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.977 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.76 -45.71 59.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.653 179.277 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.556 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 92.4 m -59.5 -43.46 93.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.199 0.523 . . . . 0.0 109.655 179.513 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.554 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.39 -29.73 65.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.194 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.819 HD22 ' HB2' ' A' ' 72' ' ' ALA . 94.1 mt -74.9 -52.97 9.9 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.038 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.13 -38.08 85.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.641 -179.849 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.8 76.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.025 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 40.9 m -62.58 -54.71 35.59 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.572 179.44 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.47 -25.03 61.28 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.697 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 3.2 mm-40 -78.06 -33.55 50.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.076 179.53 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HB3' HD13 ' A' ' 34' ' ' LEU . 57.3 mt-10 -112.9 6.94 18.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.959 -179.173 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.628 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.01 -7.21 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.795 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.604 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 72.62 -3.24 26.91 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.461 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.663 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -101.02 120.69 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-O 121.154 0.502 . . . . 0.0 110.97 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.1 pt-20 -106.15 170.69 7.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.198 -179.217 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.868 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.56 -33.03 13.86 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.124 0.488 . . . . 0.0 110.251 179.064 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.507 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -70.66 -11.46 68.95 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.479 179.837 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.414 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 7.7 mm-40 -113.7 -13.47 12.68 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.822 0.311 . . . . 0.0 111.053 179.286 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.868 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -120.32 -173.13 2.5 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.805 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.576 ' H ' ' H ' ' A' ' 102' ' ' GLU . 33.8 m -131.62 98.12 4.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.384 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.735 HD12 HD21 ' A' ' 13' ' ' LEU . 14.8 mm -70.64 102.17 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.361 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.616 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -65.3 140.02 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 110.437 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -97.83 150.97 20.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.555 -179.658 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.13 -21.85 38.49 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.651 179.634 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.55 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.3 t80 -108.93 126.17 52.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.816 0.341 . . . . 0.0 111.368 -179.59 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.687 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.8 134.29 8.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.188 179.51 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -157.78 145.66 18.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.873 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -123.48 136.18 54.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 179.561 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.904 HD13 ' CB ' ' A' ' 135' ' ' GLU . 10.8 mt -100.01 119.09 37.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.097 179.761 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -109.7 118.64 37.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.466 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.536 ' CD2' ' HG2' ' A' ' 135' ' ' GLU . 17.1 p90 -167.22 147.41 5.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.012 179.748 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.636 HG23 ' C ' ' A' ' 92' ' ' LYS . 9.9 p -83.81 112.88 21.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 179.232 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.859 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -79.85 -100.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.761 -178.494 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -45.84 88.99 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.143 0.497 . . . . 0.0 110.241 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 91' ' ' ASN . . . . . 0.523 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.4 OUTLIER -174.74 21.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.218 179.531 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 1.048 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.8 tptt -151.25 130.91 6.73 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.868 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.2 Cg_endo -67.74 118.61 5.73 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.388 2.725 . . . . 0.0 112.554 -179.436 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 1.016 ' HG2' HD13 ' A' ' 8' ' ' LEU . 8.5 mtpp -106.15 123.37 47.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.65 -178.881 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.8 m -89.21 105.75 17.99 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.292 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.718 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 20.3 t -105.7 108.19 24.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.873 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -87.41 126.55 41.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 178.062 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.784 ' HB3' HG13 ' A' ' 14' ' ' ILE . 39.1 m-85 -114.9 128.88 56.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.109 0.481 . . . . 0.0 111.76 -178.775 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.687 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -113.29 147.24 37.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.106 179.198 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.616 HD12 HG21 ' A' ' 78' ' ' ILE . 12.9 mt -78.37 132.93 37.58 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' ALA . . . . . 0.647 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -142.71 144.57 32.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.908 0.385 . . . . 0.0 111.286 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.576 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.3 tm-20 -124.6 114.7 19.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.491 179.153 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.76 HG12 HD23 ' A' ' 75' ' ' LEU . 5.1 m -71.85 123.7 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-O 121.376 0.607 . . . . 0.0 110.065 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 1.4 mttm -60.13 -28.58 68.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.29 -177.968 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 105' ' ' ASP . . . . . 0.718 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.3 t0 -102.11 121.35 42.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 0.0 111.722 -178.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -43.63 94.28 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.81 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -99.66 25.9 6.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.703 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.718 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.8 p -42.99 151.39 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.332 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 6.3 pm0 -69.95 141.85 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.174 0.511 . . . . 0.0 111.233 -179.209 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.851 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.3 mm -120.34 98.01 5.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.808 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 111' ' ' ARG . . . . . 0.604 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 3.3 mtp180 -98.32 97.51 8.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.554 -179.128 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.641 HD22 HD22 ' A' ' 34' ' ' LEU . 10.2 mt -92.66 125.51 37.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 115' ' ' GLU . 54.5 m -82.8 -166.38 1.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.357 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -75.7 19.47 0.2 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.64 0.257 . . . . 0.0 111.329 179.784 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 115' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 113' ' ' SER . 50.7 mt-10 -105.26 -34.11 7.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.788 0.327 . . . . 0.0 110.626 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 11.0 m80 -118.1 137.32 53.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' ' 37' ' ' SER . 8.1 tp-100 -85.27 -27.29 26.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.842 -179.437 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.0 174.35 6.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 111.583 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.851 ' CD1' HG21 ' A' ' 110' ' ' ILE . 23.6 p90 -136.97 174.01 11.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.509 -179.266 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HG3' ' CH2' ' A' ' 43' ' ' TRP . 1.7 mtt-85 -157.94 162.38 38.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.215 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 121' ' ' TRP . . . . . 0.657 ' CE2' HD13 ' A' ' 32' ' ' LEU . 91.0 m95 -131.0 107.16 8.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.861 179.35 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.89 172.36 12.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.012 0.434 . . . . 0.0 111.42 -178.838 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.81 -151.7 5.95 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.732 -0.746 . . . . 0.0 111.665 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 141' ' ' GLN . 5.5 tp -77.53 -39.74 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.797 0.332 . . . . 0.0 111.187 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -63.03 -50.62 69.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.797 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 126' ' ' GLU . . . . . 0.825 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -71.39 -46.9 59.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.111 -179.564 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.11 -27.55 54.29 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.225 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 128' ' ' CYS . . . . . 0.498 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -82.5 -31.77 29.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.647 178.58 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.641 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -65.99 -45.24 82.34 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.096 -179.676 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.654 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -78.47 -40.01 36.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.359 179.239 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.55 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -73.72 49.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.771 179.583 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.82 -31.23 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.151 -179.182 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.505 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 11.4 m-85 -61.6 118.75 7.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.83 0.348 . . . . 0.0 110.7 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -46.24 -38.11 8.06 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.904 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.8 mp0 -59.65 -56.98 15.08 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.273 -179.391 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 136' ' ' MET . . . . . 0.6 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -54.33 -45.13 72.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.028 -179.406 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 137' ' ' LYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.06 -35.3 46.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.591 179.672 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.47 -46.51 22.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.681 179.882 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 139' ' ' ALA . . . . . 0.978 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.11 -48.36 67.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.442 179.425 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -74.48 -25.98 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.092 178.854 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.46 -51.83 52.65 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.09 179.942 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 142' ' ' GLU . . . . . 0.499 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 10.0 mm-40 -69.93 -28.74 65.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.513 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.8 93.01 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.04 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -76.11 -28.84 57.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.342 179.394 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -70.6 -50.1 40.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.091 -179.888 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 146' ' ' PHE . . . . . 0.571 ' CE1' HD11 ' A' ' 150' ' ' ILE . 18.5 t80 -67.8 -52.08 41.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.149 -179.667 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.521 HD23 ' CD1' ' A' ' 150' ' ' ILE . 96.1 mt -57.27 -27.71 62.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.529 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.53 -21.73 66.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.683 179.804 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.43 -6.63 56.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.895 -179.687 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 150' ' ' ILE . . . . . 0.571 HD11 ' CE1' ' A' ' 146' ' ' PHE . 1.1 mt -96.87 -131.85 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 -179.893 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -175.77 -72.94 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.86 0.362 . . . . 0.0 110.842 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -176.49 -179.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 154' ' ' ATP . . . . . 0.859 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.167 0 CA-C-O 121.214 0.53 . . . . 0.0 111.399 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -106.53 139.2 41.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.788 -179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.627 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.37 125.37 33.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.13 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.565 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -136.09 167.01 22.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.744 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.502 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -157.83 123.89 4.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.079 0.466 . . . . 0.0 111.18 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.534 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.7 169.72 13.14 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.035 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.748 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -124.64 117.75 24.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.63 0.252 . . . . 0.0 111.596 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.031 HD11 ' HB1' ' A' ' 139' ' ' ALA . 23.7 mt -85.95 91.99 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.957 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.46 146.02 7.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.874 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.608 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 45.8 p90 -150.04 125.2 10.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.701 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.77 113.53 24.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.798 0.332 . . . . 0.0 110.343 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 18' ' ' ARG . 12.6 ttp180 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.151 0 CA-C-O 120.92 0.391 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.5 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -105.76 148.03 10.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.329 0.585 . . . . 0.0 111.847 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.608 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 8.4 mt-10 -122.34 173.78 7.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.863 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 34.0 m-85 -138.55 133.56 32.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.63 0.252 . . . . 0.0 111.35 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.2 tp -76.8 133.21 39.46 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.584 HD22 ' HB3' ' A' ' 43' ' ' TRP . 5.4 mt -132.98 144.53 50.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.98 0.419 . . . . 0.0 111.019 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 112' ' ' LEU . 54.3 mt -123.13 116.54 23.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 7.5 tt0 -74.55 132.35 41.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.184 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.04 179.607 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 7.9 p-80 . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.785 0.326 . . . . 0.0 110.788 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.584 ' HB3' HD22 ' A' ' 33' ' ' LEU . 72.6 m95 -108.27 123.09 48.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.4 p -147.11 151.28 40.72 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.741 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.504 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 41.7 Cg_endo -66.79 168.3 17.25 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.493 2.128 . . . . 0.0 111.86 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.556 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 36.1 Cg_exo -60.3 99.53 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.588 2.192 . . . . 0.0 112.775 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 4.4 pttt -106.83 140.1 40.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.683 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.36 178.42 16.76 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.628 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.71 94.22 5.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.791 0.329 . . . . 0.0 110.666 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.675 ' N ' HG21 ' A' ' 59' ' ' THR . 1.7 p -69.56 132.13 33.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.068 0.461 . . . . 0.0 111.031 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.539 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.3 tt0 -95.35 151.88 38.96 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.119 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.539 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.3 Cg_endo -49.38 -33.08 28.18 Favored 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.682 2.255 . . . . 0.0 112.585 -179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.521 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -90.4 -13.38 60.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.345 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -87.67 165.12 15.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.553 0.216 . . . . 0.0 110.528 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.899 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 33.8 t70 -82.79 161.34 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.078 0.466 . . . . 0.0 110.711 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.5 -63.62 1.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.689 HD21 HG21 ' A' ' 77' ' ' ILE . 15.5 tp -61.87 -40.12 94.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.491 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.899 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -50.81 -50.06 57.14 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.675 HG21 ' N ' ' A' ' 50' ' ' VAL . 86.7 m -54.88 -36.81 65.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.502 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -75.22 -32.09 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.043 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -72.03 -53.03 14.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.641 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 8.5 ttt-85 -59.02 -43.61 91.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.416 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.61 70.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.279 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.957 HG23 HD11 ' A' ' 15' ' ' ILE . 27.2 m -62.93 -53.78 48.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.328 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.499 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.4 pt20 -74.17 -23.05 59.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.726 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.47 -37.46 36.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -110.07 9.84 24.1 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.81 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.714 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -153.25 -14.55 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.536 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 80.2 -6.41 60.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.578 HG21 HD23 ' A' ' 75' ' ' LEU . 2.6 mt -98.03 127.41 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.8 pt-20 -107.5 170.3 8.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.867 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.62 -31.34 10.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.9 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.46 -21.03 79.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.184 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -97.38 -5.6 35.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.648 0.261 . . . . 0.0 111.069 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.867 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.03 -167.82 1.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.781 0.324 . . . . 0.0 110.292 179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -140.02 97.48 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.897 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.689 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -70.77 112.83 6.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.018 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.97 134.6 29.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -94.26 151.28 19.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.36 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.81 -21.98 40.14 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.524 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.819 ' CE1' HD21 ' A' ' 100' ' ' LEU . 18.9 t80 -106.29 126.55 52.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.798 0.333 . . . . 0.0 110.869 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.75 125.97 5.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.083 0.468 . . . . 0.0 111.55 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -152.45 136.47 16.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.905 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.995 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -118.74 143.9 46.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.082 0.468 . . . . 0.0 111.651 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.895 HD13 ' HB3' ' A' ' 135' ' ' GLU . 3.8 mt -100.47 124.73 46.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.137 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.487 HD21 HG23 ' A' ' 95' ' ' THR . 2.7 m-80 -114.95 120.17 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.021 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 9.0 p90 -167.07 144.83 4.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.122 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.9 p -83.99 109.0 16.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -70.78 -93.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.435 ' HG3' ' OD1' ' A' ' 91' ' ' ASN . 12.8 ptt85 -74.8 -48.17 26.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.857 0.36 . . . . 0.0 110.351 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.435 ' OD1' ' HG3' ' A' ' 90' ' ' ARG . 20.2 p-10 -171.47 30.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.669 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.779 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.37 125.58 2.65 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.557 179.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.845 ' O ' HD12 ' A' ' 8' ' ' LEU . 52.6 Cg_endo -68.08 117.79 5.17 Favored 'Trans proline' 0 CA--C 1.513 -0.571 0 C-N-CA 123.273 2.649 . . . . 0.0 112.816 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -101.5 124.35 47.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.741 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.487 HG23 HD21 ' A' ' 86' ' ' ASN . 32.7 m -90.53 112.04 23.57 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 32.5 t -109.06 108.96 26.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.642 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.995 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.68 142.89 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.504 ' CE1' ' HG2' ' A' ' 45' ' ' PRO . 7.7 m-85 -126.3 133.61 51.36 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.581 ' CH2' HG21 ' A' ' 97' ' ' ILE . 14.5 m-90 -124.07 143.34 50.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.444 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.819 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -80.96 128.53 33.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.224 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -134.43 142.17 47.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.178 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 10.9 tt0 -119.5 115.28 23.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.646 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.792 HG12 HD23 ' A' ' 75' ' ' LEU . 11.9 m -72.24 129.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 121.304 0.574 . . . . 0.0 110.653 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' CD ' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.69 -27.1 68.46 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.794 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.477 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 1.3 m-20 -106.35 132.77 52.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.111 0.481 . . . . 0.0 111.969 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -69.09 -43.25 74.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.458 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -100.21 24.02 9.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.811 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 2.9 p -41.89 147.22 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' CD ' ' A' ' 111' ' ' ARG . 0.4 OUTLIER -61.75 144.64 54.37 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.306 0.574 . . . . 0.0 110.768 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.907 HG21 ' CD1' ' A' ' 119' ' ' TYR . 30.5 mm -124.26 96.81 4.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.928 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.536 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 15.2 mtp180 -106.77 99.77 9.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.97 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 34' ' ' LEU . 8.3 mt -85.68 172.86 10.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.528 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.11 -172.72 2.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.847 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -60.13 -29.57 68.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.09 -6.98 52.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.779 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.457 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 52.9 m80 -142.05 127.88 19.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.0 110.995 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.26 -18.94 15.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.513 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.03 163.67 39.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 111.43 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.907 ' CD1' HG21 ' A' ' 110' ' ' ILE . 38.5 p90 -138.25 175.16 9.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.713 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.421 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 4.1 mtt85 -158.68 158.66 34.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 0.0 111.509 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CE2' HD13 ' A' ' 32' ' ' LEU . 87.5 m95 -127.1 106.74 9.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.62 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -138.15 167.62 21.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.066 0.46 . . . . 0.0 111.585 -178.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.74 -153.51 3.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.707 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.03 -46.69 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.843 0.322 . . . . 0.0 110.845 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.2 pt-20 -56.14 -49.34 74.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.9 -50.68 22.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.551 -179.503 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.38 -29.63 10.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 2.3 m -83.94 -33.94 24.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.392 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.29 -41.43 94.12 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.585 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.554 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -77.6 -44.33 28.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.88 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.88 52.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.142 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.401 ' O ' ' HE3' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -37.8 -34.11 0.1 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.131 -179.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.4 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 21.2 m-85 -54.8 114.77 1.84 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.127 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -45.8 -50.81 13.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.519 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.895 ' HB3' HD13 ' A' ' 85' ' ' LEU . 11.3 mp0 -46.03 -46.97 16.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.624 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.583 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -71.36 -45.24 63.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.696 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.61 -30.24 12.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -79.77 -47.01 15.94 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.842 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 1.031 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.61 -47.47 63.6 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.032 0.444 . . . . 0.0 110.423 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.583 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -73.86 -27.67 61.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.024 178.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.553 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.19 -51.45 53.42 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.639 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -67.06 -30.74 70.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.55 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.5 -56.62 22.66 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.948 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -67.78 -28.26 67.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.771 0.319 . . . . 0.0 110.45 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -68.55 -43.71 76.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -72.67 -52.58 14.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.256 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.574 HD11 ' CE2' ' A' ' 16' ' ' PHE . 32.2 mt -52.23 -34.84 47.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.658 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.53 0.2 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.264 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.595 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.016 0.436 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.952 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -104.11 127.82 51.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.113 -179.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 121.83 25.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.024 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -138.74 160.52 39.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.827 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.9 m -148.19 123.66 10.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.237 0.541 . . . . 0.0 111.146 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.411 ' CA ' ' HB3' ' A' ' 47' ' ' LYS . . . -114.85 170.94 13.45 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.678 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.727 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -124.67 117.24 23.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.859 0.361 . . . . 0.0 110.798 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.863 HD11 ' HB1' ' A' ' 139' ' ' ALA . 62.8 mt -82.87 92.32 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.818 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.64 145.73 8.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.186 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.664 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 29.0 p90 -149.62 124.08 9.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.837 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.66 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -87.12 113.51 22.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.4 . . . . 0.0 110.654 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 18' ' ' ARG . 5.9 ttp85 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.917 0.389 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.664 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.0 mt -101.17 148.33 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.616 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 16.8 mp0 -134.86 134.27 40.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.725 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -96.35 150.04 21.03 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -82.97 135.93 34.71 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.098 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.54 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.2 mt -135.54 142.65 45.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.868 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.637 HD22 ' CD2' ' A' ' 112' ' ' LEU . 8.8 mt -123.29 113.63 19.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.08 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.9 tt0 -69.09 122.26 18.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.426 179.363 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 . . . . . 0 N--CA 1.455 -0.214 0 CA-C-O 120.817 0.341 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 10.1 m95 -95.84 139.21 32.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.05 136.64 9.41 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.748 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 73.7 Cg_exo -49.17 169.08 0.11 Allowed 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.781 1.654 . . . . 0.0 111.018 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 1.5 Cg_endo -78.16 101.06 1.43 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.027 1.818 . . . . 0.0 112.141 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HB3' ' CA ' ' A' ' 12' ' ' GLY . 0.3 OUTLIER -120.88 -173.11 2.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.46 -139.41 2.67 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.352 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -131.57 127.23 36.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.554 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 0.2 OUTLIER -81.6 135.51 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-O 120.95 0.405 . . . . 0.0 110.599 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CG ' ' HB2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -87.18 170.43 12.1 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.004 -179.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 76.8 Cg_exo -49.68 -63.29 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.793 2.328 . . . . 0.0 112.87 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.9 19.27 42.77 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.432 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 30.5 tt0 -90.6 160.77 15.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.976 0.388 . . . . 0.0 110.754 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.906 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -85.31 162.69 18.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.057 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.532 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -72.13 -62.98 1.24 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.086 0.47 . . . . 0.0 110.737 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD21 HG21 ' A' ' 77' ' ' ILE . 21.9 tp -61.97 -42.53 99.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.316 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.906 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.2 mt-10 -50.35 -46.87 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.73 0.3 . . . . 0.0 110.516 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.554 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 87.6 m -54.63 -37.36 65.56 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.09 -32.74 50.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.122 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.2 mt -70.95 -53.46 14.84 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.73 -38.86 89.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.038 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.53 -33.79 76.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.045 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.818 HG23 HD11 ' A' ' 15' ' ' ILE . 90.0 m -58.55 -51.92 67.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.393 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.544 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.63 -20.96 61.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.919 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.67 -41.67 30.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.755 0.312 . . . . 0.0 111.17 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.555 ' O ' HD13 ' A' ' 34' ' ' LEU . 13.8 mt-10 -108.08 6.34 26.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.614 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 46' ' ' PRO . . . -148.24 -7.96 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.625 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 70.95 -1.94 20.87 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.143 -1.027 . . . . 0.0 113.241 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.741 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.4 mt -100.92 127.67 53.86 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.042 0 CA-C-N 117.035 0.418 . . . . 0.0 110.811 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.1 pm0 -108.32 166.6 10.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.12 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.71 -34.55 5.24 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.734 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.41 -23.78 77.24 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.292 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.527 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 2.9 mm-40 -93.72 -5.83 47.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.395 0.14 . . . . 0.0 111.233 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.42 -171.35 2.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.996 0.427 . . . . 0.0 110.64 178.775 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.8 m -138.98 99.02 3.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.591 HG13 HD21 ' A' ' 61' ' ' LEU . 7.6 mm -71.58 120.38 19.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.448 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.33 131.33 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.221 0.534 . . . . 0.0 110.937 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -90.59 148.81 22.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.211 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.72 -24.32 30.03 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.285 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CE1' HD21 ' A' ' 100' ' ' LEU . 17.0 t80 -103.71 125.62 50.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.691 0.282 . . . . 0.0 110.864 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HD2' ' HZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.09 123.59 4.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 111.414 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.5 tpt85 -152.34 138.16 18.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.683 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.951 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.3 OUTLIER -114.69 134.02 55.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.429 -179.691 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.679 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.2 mt -91.11 122.67 33.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.524 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -115.89 123.49 48.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.33 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -167.05 142.03 4.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.823 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.2 p -82.02 109.86 16.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.29 -98.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.007 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -38.3 84.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 176.79 27.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.076 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.809 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -158.82 130.67 4.09 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.478 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.884 ' O ' HD12 ' A' ' 8' ' ' LEU . 47.6 Cg_endo -66.46 120.46 7.59 Favored 'Trans proline' 0 CA--C 1.516 -0.392 0 C-N-CA 123.381 2.721 . . . . 0.0 113.024 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.952 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -101.31 123.21 45.05 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.794 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -95.73 109.0 21.36 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 t -108.41 108.82 26.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.977 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.951 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.14 125.29 40.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.56 ' HB3' HG13 ' A' ' 14' ' ' ILE . 32.7 m-85 -111.74 165.43 12.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.532 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 4.7 m-90 -152.68 138.56 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.292 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.696 ' N ' HD23 ' A' ' 100' ' ' LEU . 0.3 OUTLIER -75.84 124.92 28.11 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.524 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.565 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -131.49 143.71 50.61 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.357 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.0 tt0 -117.6 110.67 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.766 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.758 HG12 HD23 ' A' ' 75' ' ' LEU . 10.9 m -72.27 143.55 13.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.386 0.613 . . . . 0.0 111.589 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.533 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 3.8 mptp? -71.59 -12.53 61.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.885 -177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.561 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 6.5 t70 -133.35 127.61 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 111.931 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.66 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 59.7 t80 -62.54 -38.43 89.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -100.3 21.3 13.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.695 178.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -43.03 145.82 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.064 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.632 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -61.85 140.19 58.29 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.32 0.581 . . . . 0.0 110.621 -179.337 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.812 HG21 ' CG ' ' A' ' 119' ' ' TYR . 28.6 mm -123.74 95.2 3.2 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.879 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.625 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.1 mtp85 -95.3 102.32 14.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.158 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.637 ' CD2' HD22 ' A' ' 34' ' ' LEU . 11.4 mt -90.65 144.49 25.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.11 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -89.09 -156.27 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 7.0 11.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.449 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -99.12 -29.86 12.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.435 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.9 m80 -120.61 157.36 29.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.823 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -120.16 -21.4 7.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.694 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -154.59 178.6 9.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.914 0.388 . . . . 0.0 111.507 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.812 ' CG ' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -156.56 161.05 39.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.866 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.686 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -148.97 148.39 29.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.038 0.447 . . . . 0.0 111.383 179.588 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 81.2 m95 -105.96 106.9 17.62 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.3 169.71 17.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 0.0 111.666 -178.26 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.33 -151.83 3.93 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.763 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.54 -45.62 24.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.767 0.318 . . . . 0.0 111.351 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.47 -52.19 66.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.803 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.02 -46.7 67.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.558 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.54 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.54 -31.12 63.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.298 0.57 . . . . 0.0 109.763 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.4 m -82.57 -30.84 29.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.183 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.73 -43.55 88.7 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.725 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.636 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -77.73 -37.42 49.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.217 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.521 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.95 56.52 1.97 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.151 0.501 . . . . 0.0 110.085 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.438 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.57 -34.06 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.255 -179.464 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -59.5 115.32 3.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.185 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -46.17 -44.92 16.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.381 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.679 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.2 mp0 -49.31 -60.24 2.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.264 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.553 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -54.37 -40.23 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.921 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.416 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -53.41 -39.58 64.43 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.607 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.21 -44.39 30.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.378 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.19 -42.74 63.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.246 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -79.67 -29.52 40.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.015 178.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.607 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.92 -52.24 45.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.823 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -66.22 -28.91 69.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.424 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.412 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.1 -53.67 42.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.833 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.61 ' NE2' HD12 ' A' ' 29' ' ' ILE . 18.0 t-80 -71.24 -30.23 66.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 0.0 110.106 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.82 -50.3 67.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.347 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -62.39 -52.08 65.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.738 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.448 ' CD2' HG12 ' A' ' 78' ' ' ILE . 67.6 mt -55.03 -30.18 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.5 t -83.02 -8.43 59.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.594 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.299 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.623 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.149 0 CA-C-O 121.114 0.483 . . . . 0.0 111.37 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.62 142.18 41.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.524 179.644 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.7 mtt180 -78.56 137.77 38.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.639 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.655 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -149.56 162.61 39.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.599 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 16.6 m -156.42 123.5 5.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.17 0.51 . . . . 0.0 111.54 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.62 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -113.47 178.0 18.29 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.555 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.742 HD11 HD23 ' A' ' 61' ' ' LEU . 1.1 mt -135.1 118.2 16.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.047 0.424 . . . . 0.0 111.801 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.497 HG12 ' HB3' ' A' ' 98' ' ' TYR . 11.2 mm -75.67 90.9 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.837 HD11 HG23 ' A' ' 64' ' ' THR . 30.2 mt -84.97 136.65 22.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.711 -178.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.687 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.9 p90 -146.47 124.05 11.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.828 -178.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.736 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.47 113.21 18.49 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.008 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.424 -179.336 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.857 0.36 . . . . 0.0 111.501 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.687 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 12.3 mt -102.88 147.71 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 111.485 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.4 mp0 -135.85 141.39 44.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.659 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.588 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 53.4 m-85 -103.37 149.71 24.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.927 0.394 . . . . 0.0 112.018 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 43.5 tp -84.02 136.64 33.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.3 mt -136.95 143.13 42.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.609 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 112' ' ' LEU . 19.9 mt -121.31 112.29 18.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.759 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.493 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 62.4 tt0 -60.68 134.22 56.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.315 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.626 179.528 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.0 p-80 . . . . . 0 N--CA 1.455 -0.177 0 CA-C-O 120.783 0.325 . . . . 0.0 110.659 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.524 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 45.6 m95 -115.69 112.61 22.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.959 0.409 . . . . 0.0 111.267 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -125.63 143.73 45.88 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.66 171.39 12.11 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.194 1.93 . . . . 0.0 111.97 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.432 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 25.2 Cg_endo -61.49 96.24 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.436 2.091 . . . . 0.0 112.109 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.687 ' O ' ' HB1' ' A' ' 63' ' ' ALA . 7.3 mttt -86.63 170.64 11.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -166.58 128.58 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.696 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.69 109.91 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.713 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -79.42 137.02 22.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.097 0.475 . . . . 0.0 111.15 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 4.1 tt0 -95.12 151.48 38.82 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.277 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 7.4 Cg_endo -52.57 -31.02 47.45 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.71 2.273 . . . . 0.0 112.88 -179.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -91.2 -13.38 58.86 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.508 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -87.24 161.44 18.0 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.53 0.205 . . . . 0.0 110.684 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 31.1 t70 -78.29 160.89 27.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.364 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 15.5 m-20 -71.6 -62.21 1.5 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.253 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.699 HD21 HG21 ' A' ' 77' ' ' ILE . 24.8 tp -62.32 -40.44 96.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.299 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -50.32 -45.01 54.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.733 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.543 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 90.2 m -60.06 -41.81 93.16 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.23 -31.3 69.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.785 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.904 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -73.5 -52.19 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.642 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -59.5 -44.09 93.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.57 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 47' ' ' LYS . . . -58.77 -37.1 75.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.046 0.45 . . . . 0.0 110.045 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.837 HG23 HD11 ' A' ' 15' ' ' ILE . 34.7 m -60.32 -54.02 50.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.562 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 10.7 pt20 -73.23 -21.7 60.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.915 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -79.32 -41.69 27.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.219 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 -106.1 2.58 27.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.722 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.59 -8.99 0.64 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.611 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 72.51 1.02 51.04 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.934 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.622 ' CG2' HD23 ' A' ' 75' ' ' LEU . 3.9 mt -103.7 122.23 56.12 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.7 pt-20 -107.24 168.55 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.441 -179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.904 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.18 -36.13 8.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.507 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.62 78.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.109 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 0.2 OUTLIER -91.52 -6.6 52.25 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.704 0.288 . . . . 0.0 111.06 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -135.9 -176.2 4.23 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.86 0.362 . . . . 0.0 110.24 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.538 ' H ' ' H ' ' A' ' 102' ' ' GLU . 94.7 m -124.63 103.24 8.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.726 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.699 HG21 HD21 ' A' ' 57' ' ' LEU . 14.2 mm -77.63 109.79 12.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.905 0.383 . . . . 0.0 111.569 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.768 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -72.42 138.3 21.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.701 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -94.27 148.84 21.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.468 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.87 -23.09 34.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.736 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CD1' HD21 ' A' ' 100' ' ' LEU . 34.4 t80 -100.71 125.25 47.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.38 . . . . 0.0 111.075 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.48 126.09 5.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.176 0.512 . . . . 0.0 111.273 179.693 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -153.81 137.44 16.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.202 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.919 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -118.08 134.6 54.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 0.0 111.35 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.784 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.1 mt -101.62 117.82 35.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.481 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.24 126.51 53.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.144 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -166.93 140.23 3.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.646 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.6 p -80.41 108.82 14.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.557 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.62 -95.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.587 -178.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.496 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -69.98 -39.15 76.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.72 0.295 . . . . 0.0 110.875 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 6.2 t-20 176.41 29.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.853 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.646 ' N ' HG23 ' A' ' 88' ' ' VAL . 0.0 OUTLIER -157.65 123.99 2.51 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.737 179.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.6 Cg_endo -73.43 117.63 5.16 Favored 'Trans proline' 0 CA--C 1.515 -0.436 0 C-N-CA 123.025 2.483 . . . . 0.0 112.832 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 2.1 mmmt -103.0 121.73 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.349 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.549 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 55.2 m -88.74 113.61 24.49 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.74 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.9 t -112.44 109.41 28.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.222 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.919 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -84.92 130.14 36.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.497 ' HB3' HG12 ' A' ' 14' ' ' ILE . 37.4 m-85 -115.62 137.7 51.81 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.605 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.8 m-90 -125.92 143.83 50.92 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.113 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.768 HD12 HG21 ' A' ' 78' ' ' ILE . 6.2 mt -75.5 123.84 26.15 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.514 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.547 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -131.98 144.16 50.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.423 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.538 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.7 tt0 -123.64 112.63 17.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.601 0.238 . . . . 0.0 111.111 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.736 HG22 ' HG2' ' A' ' 17' ' ' ARG . 3.4 m -72.81 112.77 9.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.751 0.786 . . . . 0.0 110.387 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -8.78 14.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.517 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.876 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 6.1 m-20 -112.43 107.04 15.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.942 0.401 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CD1' ' HD2' ' A' ' 17' ' ' ARG . 2.7 t80 -55.47 -39.78 70.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -101.09 26.18 7.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.69 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.876 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.5 p -47.9 146.47 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.347 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.423 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 5.9 pm0 -68.68 143.09 54.86 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.118 0.485 . . . . 0.0 110.542 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.833 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.2 mm -120.97 97.55 5.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.511 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.611 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 19.5 mtp180 -101.84 99.92 10.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.435 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 34' ' ' LEU . 3.1 mt -92.06 -172.6 3.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.822 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.7 t -125.97 -172.57 2.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.811 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -66.58 -25.01 66.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.329 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.75 -12.53 60.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.29 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.413 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 81.7 m-70 -124.26 105.94 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.792 0.33 . . . . 0.0 110.764 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.52 -17.0 60.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.876 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.24 -179.57 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.126 0.489 . . . . 0.0 111.703 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.833 ' CD1' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -145.65 171.89 14.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.717 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 64.9 mtt180 -157.94 153.25 25.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.244 0.545 . . . . 0.0 111.675 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.566 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 90.6 m95 -118.03 107.14 13.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.367 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.771 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -136.63 173.59 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.045 0.45 . . . . 0.0 111.684 -178.555 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -79.94 -153.24 8.25 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.798 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.46 -41.16 40.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.0 pt-20 -61.05 -51.93 67.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.749 0.309 . . . . 0.0 111.413 -179.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.771 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.36 -48.72 60.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.904 0.383 . . . . 0.0 110.227 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.55 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -53.94 -27.25 29.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.411 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -83.23 -32.89 26.24 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.952 178.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.722 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.76 -46.99 82.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.66 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.4 OUTLIER -78.3 -37.19 45.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.512 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -75.36 52.22 0.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.069 0.461 . . . . 0.0 110.813 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.76 -32.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.62 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -63.4 120.53 11.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.617 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.61 -49.41 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.006 0.431 . . . . 0.0 111.175 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.784 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.9 mp0 -47.25 -53.24 13.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.673 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.522 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -60.03 -43.0 95.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.186 -179.243 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.5 OUTLIER -53.29 -36.57 61.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.571 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.01 -42.43 32.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.255 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.881 179.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.55 HD22 ' HB1' ' A' ' 127' ' ' ALA . 1.2 mt -78.39 -27.52 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.984 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.19 -51.85 33.8 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.854 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.21 -30.04 67.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.393 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.57 -49.52 72.84 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.823 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.444 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 6.4 t-160 -76.25 -36.32 58.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.053 0.454 . . . . 0.0 110.273 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -61.02 -52.72 63.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.533 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.94 -50.56 72.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.016 0.436 . . . . 0.0 111.191 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.558 ' HG ' HD13 ' A' ' 100' ' ' LEU . 94.0 mt -56.88 -31.71 65.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.678 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.16 -4.18 54.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.797 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.142 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.795 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.647 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 121.037 0.446 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.988 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.4 139.9 43.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.043 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.796 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -83.92 123.71 30.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.993 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.45 163.52 30.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 6.4 m -157.75 124.04 4.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 111.146 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.581 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.53 170.13 13.27 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.488 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.611 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -123.55 117.91 26.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.854 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.5 mt -86.77 91.74 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.996 HD11 HG23 ' A' ' 64' ' ' THR . 52.7 mt -79.94 146.31 7.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.622 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.665 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 51.4 p90 -151.33 122.27 7.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.439 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.11 112.24 18.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.548 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.701 0.286 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.665 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.9 mt -129.02 140.43 49.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.453 . . . . 0.0 111.99 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -135.24 126.93 29.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.001 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.0 m-85 -89.7 150.46 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.673 HD23 HD12 ' A' ' 15' ' ' ILE . 44.0 tp -85.88 138.53 31.97 Favored 'General case' 0 CA--C 1.523 -0.059 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.866 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.5 mt -139.13 132.77 30.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.566 HD11 ' HG3' ' A' ' 46' ' ' PRO . 17.0 mt -108.92 100.2 9.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.93 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 41.1 tt0 -55.08 133.95 49.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.922 179.02 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 24.2 p-80 . . . . . 0 N--CA 1.456 -0.139 0 CA-C-O 120.944 0.402 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.563 ' CE2' HD22 ' A' ' 130' ' ' LEU . 5.9 m95 -101.63 128.5 47.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.49 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.438 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.2 OUTLIER -137.51 139.4 27.19 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.265 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 40.7 Cg_exo -56.87 164.34 6.22 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.244 1.962 . . . . 0.0 111.975 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.566 ' HG3' HD11 ' A' ' 34' ' ' LEU . 29.0 Cg_exo -60.34 83.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.528 0.186 0 C-N-CA 122.669 2.246 . . . . 0.0 112.314 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.48 153.09 19.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.038 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.4 -154.83 6.45 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.088 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -125.36 109.33 12.64 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.547 0.213 . . . . 0.0 110.912 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.796 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -83.21 132.59 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.543 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 2.6 tt0 -95.07 152.15 39.3 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.417 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.543 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.9 Cg_endo -49.26 -31.29 21.87 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.945 2.43 . . . . 0.0 112.831 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.535 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -94.97 -10.66 57.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.304 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -88.6 158.71 18.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.512 0.196 . . . . 0.0 110.589 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.852 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.2 t0 -76.78 160.34 29.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.012 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.92 -61.5 1.83 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.221 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.468 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.6 tp -61.39 -42.14 98.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.747 0.308 . . . . 0.0 111.076 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.852 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.26 -46.7 55.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.373 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.609 HG21 ' N ' ' A' ' 50' ' ' VAL . 89.2 m -55.66 -42.32 74.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.33 -32.7 68.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.059 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.922 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -71.19 -52.97 16.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.603 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 mtt180 -58.09 -39.28 78.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.748 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.6 -30.39 71.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.114 0.483 . . . . 0.0 109.945 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.996 HG23 HD11 ' A' ' 15' ' ' ILE . 18.5 m -65.04 -50.94 64.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.64 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.57 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.5 pp0? -76.05 -24.85 55.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.933 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -79.04 -37.56 38.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.902 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -104.27 -8.81 19.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.911 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.42 -3.25 1.73 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.79 0.24 32.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.619 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.618 HG21 HD23 ' A' ' 75' ' ' LEU . 2.3 mt -103.95 123.99 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.81 167.12 10.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.922 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -48.53 -27.62 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.251 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.29 -21.03 76.44 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.227 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HG2' HG23 ' A' ' 70' ' ' ILE . 1.2 tp60 -98.06 -9.39 26.03 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.793 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -126.03 -171.23 2.34 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.097 0.475 . . . . 0.0 110.514 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 83.9 m -133.85 100.67 4.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.385 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 101' ' ' ALA . 8.1 mm -74.14 118.38 19.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.517 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.74 132.83 30.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -91.04 148.57 22.3 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.122 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.1 -26.8 19.44 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.588 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.481 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.6 t80 -103.49 124.26 48.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.0 111.038 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 127.93 6.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.196 179.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.89 142.68 17.74 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.169 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.946 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.2 pm0 -120.87 141.4 50.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.105 0.479 . . . . 0.0 111.816 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.867 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -101.36 118.73 37.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.078 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.408 ' ND2' HG23 ' A' ' 95' ' ' THR . 1.0 OUTLIER -111.42 124.44 52.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.144 0.497 . . . . 0.0 111.038 -179.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.442 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 25.6 p90 -167.08 145.86 5.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.823 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.61 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.4 p -85.62 111.86 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.764 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.43 -106.34 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.278 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -39.61 93.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.858 0.361 . . . . 0.0 110.555 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.4 t30 178.25 30.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.968 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.776 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -156.45 125.4 3.03 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.826 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.3 116.49 4.64 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 123.206 2.604 . . . . 0.0 112.825 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.988 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -99.95 128.39 46.05 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.699 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.408 HG23 ' ND2' ' A' ' 86' ' ' ASN . 52.6 m -95.59 104.95 16.89 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.653 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 36.2 t -104.05 108.43 24.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.966 -178.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.946 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.38 136.62 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.466 ' CZ ' HG11 ' A' ' 96' ' ' VAL . 37.2 m-85 -123.49 129.86 51.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.473 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 3.8 m-90 -115.03 148.88 38.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.026 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.523 HD13 ' HG ' ' A' ' 147' ' ' LEU . 6.6 mt -83.29 127.47 33.68 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.61 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.97 144.6 48.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.627 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.432 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -123.31 116.74 23.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.793 0.33 . . . . 0.0 111.396 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.751 HG12 HD23 ' A' ' 75' ' ' LEU . 4.8 m -76.93 121.04 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 121.447 0.642 . . . . 0.0 110.833 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.407 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.99 -22.24 66.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.522 -179.26 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.784 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 4.6 m-20 -104.94 119.83 39.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.987 0.422 . . . . 0.0 111.712 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -43.88 95.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.168 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -96.22 21.26 9.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.079 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.784 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -42.26 145.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.367 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.707 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -62.03 141.2 58.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.318 0.58 . . . . 0.0 111.3 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.925 HG21 ' CD2' ' A' ' 119' ' ' TYR . 35.4 mm -123.99 100.48 7.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.707 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -99.67 101.61 12.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.416 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.512 HD11 ' HD2' ' A' ' 119' ' ' TYR . 17.3 mt -92.75 163.87 13.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.43 -168.9 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -64.46 -18.53 64.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.347 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.93 -18.25 35.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.688 0.28 . . . . 0.0 111.17 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 77.3 m-70 -120.02 136.78 54.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.535 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.6 tp60 -109.74 -19.17 13.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.533 -179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.52 166.25 16.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.869 0.366 . . . . 0.0 111.198 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.925 ' CD2' HG21 ' A' ' 110' ' ' ILE . 43.0 p90 -139.74 173.59 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.841 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.461 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 26.4 mtt-85 -160.68 158.33 28.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 0.0 111.486 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.462 ' CE2' HD13 ' A' ' 32' ' ' LEU . 86.3 m95 -122.09 107.4 12.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.28 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.67 172.7 12.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.065 0.46 . . . . 0.0 111.833 -178.198 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.0 -151.47 6.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.233 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.9 tp -77.3 -46.05 24.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.574 0.226 . . . . 0.0 111.539 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.7 pt-20 -58.18 -51.43 69.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.496 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -67.55 -54.1 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.069 0.461 . . . . 0.0 110.242 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -49.87 -31.11 11.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 0.0 110.157 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.7 m -83.86 -30.79 26.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.736 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -63.87 -43.4 96.18 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.788 -179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.563 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -77.66 -42.55 34.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.184 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.79 54.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 0.0 110.165 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.67 -33.9 0.09 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.302 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -59.59 120.54 9.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.676 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.38 -54.71 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.246 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.867 ' HB3' HD13 ' A' ' 85' ' ' LEU . 21.4 mp0 -41.67 -54.74 3.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.143 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.616 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.01 -44.64 95.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.206 -179.203 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.03 -42.58 49.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.384 . . . . 0.0 109.994 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.45 -45.04 73.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.76 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.854 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.16 -42.62 66.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -81.81 -29.2 32.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.319 179.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -62.71 -51.62 66.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.904 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.84 -29.24 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.483 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.08 72.3 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.215 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 59.4 t-80 -80.41 -29.48 37.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.63 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -67.01 -52.63 40.18 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.243 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -63.3 -49.29 74.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 -179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.523 ' HG ' HD13 ' A' ' 100' ' ' LEU . 78.7 mt -57.26 -32.93 67.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.838 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -70.32 -16.64 63.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.8 0.333 . . . . 0.0 110.946 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.232 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.513 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.597 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 121.065 0.46 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -106.69 125.83 51.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.539 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' CD2' ' A' ' 49' ' ' HIS . 0.3 OUTLIER -79.09 115.58 18.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.099 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' ' O ' ' A' ' 95' ' ' THR . . . -126.78 160.65 30.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.481 ' SG ' HG11 ' A' ' 50' ' ' VAL . 87.4 m -152.01 123.49 7.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.696 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.615 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -114.69 177.59 17.56 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.016 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.68 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -127.55 117.42 22.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.704 0.288 . . . . 0.0 111.44 -179.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.864 HD11 ' HB1' ' A' ' 139' ' ' ALA . 73.4 mt -83.95 91.37 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 17.3 mt -79.23 145.22 9.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.238 -178.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.609 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.8 p90 -148.37 121.95 9.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.849 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 121' ' ' TRP . 3.9 ttp180 -85.95 112.75 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.001 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 121.071 0.463 . . . . 0.0 111.439 -179.492 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.768 0.318 . . . . 0.0 111.469 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.609 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.5 mt -112.31 141.8 26.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 0.0 112.02 -179.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -128.18 136.08 50.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.098 179.593 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.564 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 50.5 m-85 -95.66 154.37 17.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.637 HD23 ' CD1' ' A' ' 15' ' ' ILE . 56.2 tp -86.93 134.41 33.51 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.496 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.2 mt -135.94 140.23 43.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 112' ' ' LEU . 43.3 mt -115.64 127.42 55.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.454 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -65.93 157.47 30.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.174 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.721 -179.666 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' CD2' ' A' ' 42' ' ' HIS . 5.8 p-80 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 120.912 0.386 . . . . 0.0 110.598 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.5 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 41.7 m95 -101.68 129.97 47.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.3 p -149.06 143.97 17.57 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -56.16 159.61 12.25 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.313 2.009 . . . . 0.0 112.034 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.592 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 42.9 Cg_exo -57.83 88.9 0.05 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.684 2.256 . . . . 0.0 112.321 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.1 OUTLIER -104.64 156.21 18.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 111.319 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.45 -152.85 6.74 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.451 ' CD2' ' O ' ' A' ' 9' ' ' ARG . 9.8 t-80 -135.54 106.08 6.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.585 ' N ' HG21 ' A' ' 59' ' ' THR . 1.5 p -78.64 129.45 37.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 121.146 0.498 . . . . 0.0 111.472 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.583 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.2 tt0 -91.21 153.54 44.64 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.148 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.8 Cg_endo -44.0 -38.46 10.35 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.108 2.538 . . . . 0.0 113.004 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.583 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.93 -4.16 63.49 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.982 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -91.32 154.6 19.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.723 0.261 . . . . 0.0 110.856 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 17.3 t70 -73.03 158.45 35.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.995 0.426 . . . . 0.0 110.104 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -74.58 -65.38 0.87 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.809 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.737 HD21 HG21 ' A' ' 77' ' ' ILE . 20.2 tp -59.71 -37.65 79.45 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.704 0.287 . . . . 0.0 110.754 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.1 mt-10 -50.27 -50.03 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.379 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.585 HG21 ' N ' ' A' ' 50' ' ' VAL . 20.7 m -54.7 -42.5 71.55 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -70.52 -32.33 69.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.887 178.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.89 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.0 mt -71.04 -52.31 20.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.312 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -61.77 -42.81 99.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.464 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' ' 66' ' ' GLU . . . -60.36 -33.06 71.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.236 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 97.6 m -63.73 -49.28 73.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.36 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.563 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 12.3 pt20 -80.32 -23.26 40.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.716 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.419 ' HB3' ' HA ' ' A' ' 63' ' ' ALA . 22.5 tp10 -79.0 -31.8 44.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -111.63 -14.6 13.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.625 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -130.69 -5.35 4.1 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.486 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.95 1.83 49.59 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.026 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.772 ' O ' HG22 ' A' ' 64' ' ' THR . 2.9 mt -104.11 125.33 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 CA-C-O 120.918 0.389 . . . . 0.0 110.619 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.1 pt-20 -105.69 168.38 9.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.89 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.47 -36.36 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.762 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.83 -22.44 76.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.99 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.487 ' HB3' HG23 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -93.21 -5.08 50.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.607 0.241 . . . . 0.0 111.191 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.864 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.21 -166.16 1.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.784 0.326 . . . . 0.0 110.376 178.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 90.3 m -139.33 97.85 3.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.513 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.737 HG21 HD21 ' A' ' 57' ' ' LEU . 11.1 mm -71.42 106.33 2.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.212 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.777 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.37 133.35 32.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.596 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.53 151.14 20.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.251 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -21.51 40.36 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.884 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.481 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 19.9 t80 -105.36 127.78 53.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.791 0.329 . . . . 0.0 111.496 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.425 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 6.7 ttpt -158.52 128.06 5.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.525 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.79 147.68 25.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.722 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.8 OUTLIER -128.27 138.04 52.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.189 0.518 . . . . 0.0 111.951 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.892 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.6 mt -99.45 124.75 44.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.122 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.616 HD21 HG23 ' A' ' 95' ' ' THR . 2.5 m-80 -114.21 124.76 52.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.32 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -167.49 146.87 5.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.097 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.63 HG23 ' CA ' ' A' ' 92' ' ' LYS . 11.0 p -89.55 107.68 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.721 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -74.91 -101.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.563 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 90' ' ' ARG . 0.1 OUTLIER -60.47 -49.43 77.59 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-O 120.91 0.386 . . . . 0.0 110.579 -179.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.07 27.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.187 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.843 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.59 131.43 5.94 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 120.931 0.396 . . . . 0.0 110.635 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.89 ' O ' HD12 ' A' ' 8' ' ' LEU . 57.9 Cg_endo -69.33 120.0 6.9 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.56 2.84 . . . . 0.0 112.869 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.836 ' HG2' HD13 ' A' ' 8' ' ' LEU . 18.3 mtpp -105.05 128.29 53.26 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.098 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.616 HG23 HD21 ' A' ' 86' ' ' ASN . 41.4 m -95.5 109.12 21.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.5 t -106.82 108.51 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.73 128.27 39.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.595 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.8 m-85 -116.63 131.45 56.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -177.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.542 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.3 m-90 -116.36 155.86 27.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.248 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.777 HD12 HG21 ' A' ' 78' ' ' ILE . 2.6 mt -89.83 124.42 34.65 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.08 137.1 46.26 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.75 0.309 . . . . 0.0 110.812 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CE1' ' A' ' 16' ' ' PHE . 13.8 tt0 -113.4 114.53 26.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.572 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.796 HG12 HD23 ' A' ' 75' ' ' LEU . 8.3 m -72.75 101.22 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 121.427 0.632 . . . . 0.0 110.311 179.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.423 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -56.83 -9.64 0.85 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.417 -178.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.854 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 9.8 m-20 -108.41 100.87 10.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.933 0.396 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.27 -38.81 59.29 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.992 0.425 . . . . 0.0 110.574 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.58 26.9 5.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.708 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.854 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.7 p -51.5 144.48 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.293 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -70.71 143.88 51.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.999 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 119' ' ' TYR . 35.9 mm -121.7 98.97 6.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.486 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.04 103.14 15.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.85 -179.307 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.5 mt -91.81 173.18 8.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.03 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.9 p -117.15 -172.22 2.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -66.82 -12.49 59.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.668 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -90.7 -23.37 20.74 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.599 0.237 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.1 m80 -113.93 118.92 35.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.933 0.397 . . . . 0.0 110.878 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -85.35 -22.32 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.382 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.33 -177.14 3.93 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.927 0.394 . . . . 0.0 111.497 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.8 ' CD1' HG21 ' A' ' 110' ' ' ILE . 44.5 p90 -148.96 174.4 12.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.439 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 7.3 mtt180 -157.07 149.54 23.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.267 0.556 . . . . 0.0 111.851 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 94.6 m95 -112.78 106.83 15.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.325 178.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.29 167.61 21.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.1 0.476 . . . . 0.0 111.677 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.8 -165.55 28.94 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.912 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.4 tp -64.54 -43.29 94.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.99 -53.8 54.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.51 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.741 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.48 -48.28 56.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.937 0.399 . . . . 0.0 110.1 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.453 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -52.81 -26.93 15.99 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.444 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.8 OUTLIER -82.97 -38.58 22.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.804 178.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.741 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -58.33 -45.2 88.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.844 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.631 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -78.71 -38.42 39.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.289 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.451 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.23 50.19 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.713 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.43 -32.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -59.9 119.69 8.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.773 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -46.48 -50.16 17.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.569 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.892 ' HB3' HD13 ' A' ' 85' ' ' LEU . 35.6 mp0 -48.25 -54.76 12.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.139 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.622 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.17 -44.0 97.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.752 0.31 . . . . 0.0 110.934 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.444 ' HG2' ' SG ' ' A' ' 128' ' ' CYS . 0.0 OUTLIER -49.12 -39.28 27.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.158 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.7 -47.05 50.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.599 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.864 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.59 -46.72 67.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.322 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.441 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -75.45 -27.62 58.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.115 178.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.95 -51.8 55.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.209 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.481 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -73.79 -29.68 62.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.481 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.54 -50.32 66.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.757 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -70.25 -37.61 74.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.097 0.475 . . . . 0.0 110.077 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 45.9 tp60 -59.77 -52.49 65.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.245 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -55.08 -55.41 31.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.926 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.429 ' CD2' HG12 ' A' ' 78' ' ' ILE . 87.6 mt -58.56 -41.22 85.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.08 -12.96 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.691 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.14 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 121.098 0.475 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -108.66 137.26 46.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.751 179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.486 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -81.84 129.72 34.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.828 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.614 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -142.09 164.07 31.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.258 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 28.1 m -153.49 123.67 7.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.407 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.51 173.93 15.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.861 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.723 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.8 OUTLIER -127.89 117.89 22.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.959 0.38 . . . . 0.0 111.336 -179.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.898 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.8 mt -84.73 91.7 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.93 HD11 HG23 ' A' ' 64' ' ' THR . 52.4 mt -81.99 145.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.33 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.656 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 42.9 p90 -148.98 121.41 8.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.776 -179.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.407 ' C ' ' HD3' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -84.59 113.81 21.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.03 0.443 . . . . 0.0 110.688 179.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.025 -179.989 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.115 0 CA-C-O 120.962 0.411 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.656 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.7 mt -87.29 154.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.569 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.3 mt-10 -135.63 125.06 24.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.508 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 52.0 m-85 -91.15 145.28 24.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.55 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.691 HD23 HD12 ' A' ' 15' ' ' ILE . 55.4 tp -85.09 138.93 32.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.05 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 34' ' ' LEU . 3.4 mt -139.11 144.21 38.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 112' ' ' LEU . 24.3 mt -122.69 107.23 11.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.752 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.543 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.3 tt0 -64.45 136.75 57.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.002 0.429 . . . . 0.0 111.314 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.819 179.519 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.903 0.383 . . . . 0.0 111.225 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.543 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 30.1 m95 -113.15 142.86 45.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.248 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.8 OUTLIER -158.86 138.54 8.56 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 170.41 2.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.547 2.164 . . . . 0.0 112.055 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.572 ' HG3' HD11 ' A' ' 34' ' ' LEU . 31.8 Cg_exo -58.81 99.79 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.58 2.186 . . . . 0.0 112.517 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HD3' HG21 ' A' ' 96' ' ' VAL . 0.2 OUTLIER -94.12 148.94 21.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.611 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.475 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -131.16 178.76 17.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.839 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -121.17 90.69 3.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.663 0.268 . . . . 0.0 110.728 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.834 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -71.26 132.99 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.007 0.432 . . . . 0.0 111.04 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.534 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.4 tt0 -96.8 151.72 38.01 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.854 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 2.6 Cg_endo -47.84 -30.32 13.06 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.864 2.376 . . . . 0.0 112.704 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.528 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -96.74 -9.7 56.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.525 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -87.65 162.17 17.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.492 0.187 . . . . 0.0 110.632 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.861 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 11.8 t70 -78.45 161.35 27.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.997 0.427 . . . . 0.0 110.346 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.404 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 34.9 m-20 -74.24 -64.7 0.96 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.415 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.569 HD21 HG21 ' A' ' 77' ' ' ILE . 10.6 tp -61.52 -40.14 93.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.226 -179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.861 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.92 -50.08 58.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.61 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.834 HG21 ' N ' ' A' ' 50' ' ' VAL . 99.5 m -55.34 -39.19 69.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.861 0.362 . . . . 0.0 110.144 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.77 -38.86 67.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.685 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.875 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.9 mt -64.48 -52.91 55.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.518 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -43.78 97.42 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.47 -33.7 71.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.019 0.438 . . . . 0.0 110.156 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.93 HG23 HD11 ' A' ' 15' ' ' ILE . 23.8 m -60.53 -51.02 71.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.276 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.533 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 8.2 pt20 -77.76 -25.11 48.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.048 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -76.52 -32.66 58.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.08 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.449 ' O ' HD13 ' A' ' 34' ' ' LEU . 2.9 mt-10 -114.92 -0.18 13.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.868 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.04 -8.54 0.7 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.49 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 74.12 -1.32 49.2 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.183 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.646 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.0 mt -103.06 126.1 57.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 117.034 0.417 . . . . 0.0 111.231 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.3 pt-20 -109.92 169.35 8.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.0 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.875 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.5 -36.81 24.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.356 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.53 -15.63 68.62 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.394 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.437 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 1.5 tp-100 -101.48 -11.85 19.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.638 0.256 . . . . 0.0 111.299 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.18 -171.5 2.43 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 121.021 0.438 . . . . 0.0 110.512 179.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.452 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 88.2 m -132.6 99.77 4.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.664 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.569 HG21 HD21 ' A' ' 57' ' ' LEU . 10.0 mm -71.63 120.52 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.191 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.566 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.66 136.51 23.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -94.82 150.62 20.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.227 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.42 -18.5 55.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.867 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.838 ' CD1' HD21 ' A' ' 100' ' ' LEU . 14.3 t80 -109.74 128.06 55.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.874 0.368 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 130.93 7.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -153.57 140.7 19.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.56 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.973 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.2 pm0 -119.46 124.23 46.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.786 0.327 . . . . 0.0 111.08 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.59 HD13 ' CB ' ' A' ' 135' ' ' GLU . 7.3 mt -91.15 125.31 35.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.522 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -118.03 121.42 40.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.487 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.41 ' CD2' ' OE2' ' A' ' 135' ' ' GLU . 22.9 p90 -167.11 142.66 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.81 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.562 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -77.63 112.56 15.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.398 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -83.53 -98.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.528 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -43.23 98.26 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.915 0.388 . . . . 0.0 110.637 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.08 31.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.789 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -163.42 129.54 2.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.344 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.878 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.9 Cg_endo -66.81 119.41 6.43 Favored 'Trans proline' 0 CA--C 1.514 -0.523 0 C-N-CA 123.328 2.686 . . . . 0.0 112.912 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -103.5 120.75 41.46 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.974 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.9 m -85.59 106.43 16.89 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 t -105.11 108.58 25.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.102 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.973 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.49 129.03 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.519 ' HB3' HG13 ' A' ' 14' ' ' ILE . 44.5 m-85 -117.61 158.34 24.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.431 0.634 . . . . 0.0 112.682 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.47 ' CH2' HG21 ' A' ' 97' ' ' ILE . 8.4 m-90 -143.73 150.61 38.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.889 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -86.22 121.33 28.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -129.81 147.19 51.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.122 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.519 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.9 OUTLIER -121.81 116.17 23.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.205 -179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 HD23 ' A' ' 75' ' ' LEU . 10.0 m -76.02 116.27 18.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.302 0.572 . . . . 0.0 110.989 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -24.98 63.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.725 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.805 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 22.1 m-20 -99.29 112.76 24.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.142 0.496 . . . . 0.0 111.418 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -57.46 -45.64 84.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.181 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.26 25.19 5.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.861 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.805 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 3.2 p -43.92 145.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.004 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -66.35 142.1 57.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.294 0.568 . . . . 0.0 110.998 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.6 mm -121.75 98.15 5.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.49 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.9 OUTLIER -101.16 101.83 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.999 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 34' ' ' LEU . 12.8 mt -87.9 173.15 9.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.159 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.3 -167.07 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.989 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -68.68 -14.07 62.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.403 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.03 -17.87 31.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.692 0.282 . . . . 0.0 111.427 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.452 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 90.2 m-70 -130.17 129.63 43.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.785 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -21.26 18.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.701 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.78 -177.66 6.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.989 0.424 . . . . 0.0 111.643 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.1 p90 -156.46 169.19 25.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.468 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -160.86 154.64 22.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 111.569 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -111.12 107.44 16.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.632 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -134.12 168.35 19.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.378 -178.553 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.16 -152.53 5.91 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.946 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.435 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.1 tp -77.11 -45.8 25.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.853 0.327 . . . . 0.0 111.334 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -58.04 -48.97 78.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.593 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.797 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.46 -48.98 36.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.881 0.372 . . . . 0.0 110.514 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.452 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.15 -30.11 35.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.326 0.584 . . . . 0.0 109.772 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.65 -32.79 25.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.408 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.797 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.0 -42.13 97.27 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.461 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.611 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -78.28 -41.67 33.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.359 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.7 55.97 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.726 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.406 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.32 -33.14 0.09 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -57.69 113.36 1.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.59 -41.2 14.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.392 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.59 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.6 mp0 -55.01 -51.53 65.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.185 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -62.85 -44.79 95.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -49.67 -39.51 36.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.965 0.412 . . . . 0.0 109.915 179.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.591 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.43 -45.55 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.543 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.898 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.77 -44.32 63.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.173 0.511 . . . . 0.0 110.215 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.04 -28.18 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.224 179.194 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.591 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.04 -51.99 53.14 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.81 -29.98 68.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.409 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.21 -57.02 21.26 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.807 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.458 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.7 t-160 -67.87 -33.1 74.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.762 0.315 . . . . 0.0 110.262 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -63.02 -52.55 62.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -64.33 -47.68 78.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.458 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.45 ' HG ' HD13 ' A' ' 100' ' ' LEU . 45.1 mt -57.31 -28.72 63.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.443 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -80.38 -14.16 58.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.931 0.396 . . . . 0.0 110.425 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 69.3 m . . . . . 0 N--CA 1.454 -0.228 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.283 179.728 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 121.299 0.571 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.948 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.66 140.18 39.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.453 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.696 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.82 131.69 35.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.132 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.61 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -144.26 165.09 28.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.597 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 18.7 m -155.88 123.59 5.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.183 0.516 . . . . 0.0 111.418 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.55 175.45 16.15 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.586 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.694 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.0 OUTLIER -130.92 117.53 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.153 0.476 . . . . 0.0 111.518 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.97 HD11 ' HB1' ' A' ' 139' ' ' ALA . 44.9 mt -84.33 91.27 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.948 HD11 HG23 ' A' ' 64' ' ' THR . 21.2 mt -79.01 146.11 8.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.856 -1.065 . . . . 0.0 111.686 -177.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.754 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.2 p90 -152.48 122.9 7.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.568 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.77 113.76 19.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.647 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' CB ' ' HG3' ' A' ' 102' ' ' GLU . 22.8 ttm180 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.313 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 120.7 0.286 . . . . 0.0 111.724 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.754 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.6 mt -102.47 151.03 6.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.116 0.484 . . . . 0.0 111.943 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 2.3 mt-10 -137.76 129.57 28.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.821 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.603 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.2 m-85 -91.91 148.86 21.89 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 ' CD1' ' A' ' 15' ' ' ILE . 46.4 tp -85.15 137.08 33.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.925 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.6 mt -137.13 138.31 40.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.368 . . . . 0.0 111.057 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 46' ' ' PRO . 11.1 mt -118.21 119.08 33.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.642 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.468 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 40.9 tt0 -82.48 133.84 35.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.538 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.382 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.923 0.392 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.533 ' CG ' ' HB3' ' A' ' 130' ' ' LEU . 78.1 m95 -104.32 131.8 51.25 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.936 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.762 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -158.07 156.31 27.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.959 -179.791 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.8 176.89 9.42 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.378 2.052 . . . . 0.0 111.984 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 34' ' ' LEU . 39.2 Cg_exo -60.58 114.58 2.2 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.542 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -103.61 142.35 34.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.047 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -132.62 172.52 21.23 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.235 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -120.9 95.13 4.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.814 0.34 . . . . 0.0 111.122 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.738 ' N ' HG21 ' A' ' 59' ' ' THR . 1.9 p -70.1 132.25 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.694 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.5 tt0 -96.98 152.4 38.32 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.85 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.1 Cg_endo -45.12 -33.99 8.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.018 2.479 . . . . 0.0 112.866 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.694 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.37 -10.42 59.41 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.594 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -86.45 168.0 14.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.608 0.242 . . . . 0.0 110.795 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.853 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.5 t70 -85.95 161.37 19.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 110.698 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.458 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -73.67 -65.67 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.867 -179.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.77 HD21 HG21 ' A' ' 77' ' ' ILE . 22.2 tp -62.28 -38.94 91.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.307 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.88 -50.17 57.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.468 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.738 HG21 ' N ' ' A' ' 50' ' ' VAL . 61.4 m -54.64 -38.98 67.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -74.07 -31.11 62.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.043 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.893 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.5 mt -74.18 -53.04 10.67 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.882 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -60.36 -42.96 96.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.542 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -33.82 71.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 0.0 110.038 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.948 HG23 HD11 ' A' ' 15' ' ' ILE . 32.7 m -62.45 -54.24 43.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.586 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.574 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -71.56 -21.16 61.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.165 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.61 -42.64 24.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.743 0.306 . . . . 0.0 111.017 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -105.49 6.16 32.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.637 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.61 -8.59 0.37 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.461 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 70.88 0.92 36.44 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.233 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.574 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -104.23 121.43 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-O 120.968 0.414 . . . . 0.0 110.778 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.3 pm0 -104.89 169.35 8.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.893 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -52.54 -26.78 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 110.705 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.413 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -75.05 -11.1 84.16 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.108 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.428 ' HG2' HG23 ' A' ' 70' ' ' ILE . 70.0 tp60 -110.58 -16.07 13.73 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.455 0.169 . . . . 0.0 111.102 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -119.55 -170.17 1.89 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.935 0.397 . . . . 0.0 110.512 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.514 ' H ' ' H ' ' A' ' 102' ' ' GLU . 60.4 m -136.36 102.13 4.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.172 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.77 HG21 HD21 ' A' ' 57' ' ' LEU . 9.7 mm -74.11 124.31 31.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.286 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.495 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.95 136.04 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.281 0.562 . . . . 0.0 111.273 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -96.31 147.83 23.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.61 -29.59 11.17 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.888 ' CD1' HD21 ' A' ' 100' ' ' LEU . 20.0 t80 -102.95 129.79 49.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.76 0.314 . . . . 0.0 110.886 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.56 129.05 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.413 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -149.15 136.01 19.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.133 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.953 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.0 pm0 -122.31 127.79 50.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.952 0.406 . . . . 0.0 111.24 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.017 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.1 mt -91.84 120.66 32.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.499 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -109.84 124.47 51.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.597 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 23.5 p90 -166.83 144.3 4.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.814 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.611 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.7 p -85.15 108.88 17.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.909 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.94 -97.93 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.158 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -62.28 -50.09 73.06 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.861 0.363 . . . . 0.0 110.682 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -175.1 29.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.244 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.727 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -161.69 130.45 3.03 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.515 179.47 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.841 ' O ' HD12 ' A' ' 8' ' ' LEU . 51.3 Cg_endo -68.32 117.8 5.2 Favored 'Trans proline' 0 CA--C 1.518 -0.313 0 C-N-CA 123.204 2.603 . . . . 0.0 112.789 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.948 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -100.98 117.35 34.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.86 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 54.7 m -80.75 112.54 18.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 177.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.6 t -110.47 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.656 -178.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.953 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.0 130.24 36.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.57 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.5 m-85 -115.52 128.81 56.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.025 0.441 . . . . 0.0 112.089 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CD2' HD13 ' A' ' 57' ' ' LEU . 4.2 m-90 -116.36 146.82 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.097 178.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.888 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -83.46 113.97 21.14 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.36 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.58 147.01 46.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.916 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.565 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tm-20 -123.0 115.45 21.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.337 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.764 HG12 HD23 ' A' ' 75' ' ' LEU . 10.7 m -73.27 122.99 27.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.243 0.544 . . . . 0.0 110.499 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 2.5 mttt -59.94 -26.31 65.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.847 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.674 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 54.1 t0 -105.81 125.69 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 111.828 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -41.09 99.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.283 0.563 . . . . 0.0 109.645 179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -100.03 24.13 8.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.541 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.674 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 3.5 p -40.93 152.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.215 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.712 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 3.0 pm0 -62.16 139.81 58.45 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.331 0.586 . . . . 0.0 111.161 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.893 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.6 mm -124.52 96.95 4.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.705 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.712 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -101.6 99.67 9.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.436 -178.702 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.679 HD11 ' HD1' ' A' ' 119' ' ' TYR . 12.9 mt -92.82 161.18 14.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.912 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -113.57 -169.24 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.389 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -65.99 -13.96 60.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.225 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -84.97 -18.97 32.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.038 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 63.1 m-70 -134.3 109.65 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.726 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -88.99 2.13 54.45 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.0 160.61 6.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.062 0.458 . . . . 0.0 111.673 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.893 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.2 p90 -140.13 173.02 11.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.51 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.635 ' NH1' HD21 ' A' ' 130' ' ' LEU . 28.4 mtp180 -157.14 156.31 32.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.217 0.532 . . . . 0.0 111.967 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.456 ' CE2' HD13 ' A' ' 32' ' ' LEU . 92.3 m95 -122.35 107.13 11.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.471 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -139.33 172.15 13.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.064 0.459 . . . . 0.0 111.794 -178.322 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.82 -154.5 7.93 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.956 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.5 tp -76.39 -41.83 46.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.745 0.307 . . . . 0.0 111.291 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.9 pt-20 -61.21 -50.3 73.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.404 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.847 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.29 -42.67 65.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.715 -179.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.518 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -59.58 -30.6 68.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.9 m -82.45 -35.75 27.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.847 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -61.37 -43.17 99.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.78 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.635 HD21 ' NH1' ' A' ' 120' ' ' ARG . 1.5 mt -77.6 -44.7 27.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.002 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.99 56.1 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.017 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.91 -34.92 0.17 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.186 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.454 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 9.8 m-85 -53.36 114.87 1.64 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.4 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.36 -50.18 12.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.28 -179.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 1.017 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.7 mp0 -48.14 -53.1 17.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.516 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.762 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.11 -47.25 85.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.324 -179.087 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.5 -40.41 37.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.958 0.409 . . . . 0.0 110.352 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.589 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.91 -47.86 60.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.945 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.97 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.11 -44.31 64.38 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.241 0.543 . . . . 0.0 109.919 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -76.88 -27.3 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.078 179.033 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.589 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.82 -52.41 37.2 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.01 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.74 -28.89 62.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.441 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.493 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.21 -40.77 97.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.65 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 -79.0 -27.39 43.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.033 0.444 . . . . 0.0 110.466 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -73.46 -52.49 13.47 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.269 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -58.97 -52.2 66.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.138 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.495 ' CD2' HG12 ' A' ' 78' ' ' ILE . 74.5 mt -53.99 -42.81 69.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.449 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -13.03 60.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.478 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.48 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.231 0.124 0 CA-C-O 121.115 0.483 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.909 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.41 130.14 53.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.651 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.633 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.44 120.79 25.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.446 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.02 170.92 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.411 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.2 m -159.58 123.98 3.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 111.098 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.507 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.73 178.97 19.12 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.765 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.78 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.1 mt -133.6 118.02 17.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.969 0.385 . . . . 0.0 111.469 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.029 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.2 mt -87.52 91.64 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.853 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -78.12 146.29 8.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.587 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.66 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 35.9 p90 -150.04 123.24 8.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -81.66 113.07 19.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 120.96 0.409 . . . . 0.0 112.046 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 -0.122 0 CA-C-O 120.947 0.403 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.66 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -117.2 140.98 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.433 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.3 mp0 -126.91 138.51 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.889 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.545 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 49.8 m-85 -100.59 152.24 20.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.97 0.414 . . . . 0.0 112.05 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 15' ' ' ILE . 53.0 tp -84.02 134.37 34.63 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.774 178.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 43' ' ' TRP . 3.6 mt -132.62 142.41 49.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.863 0.363 . . . . 0.0 110.951 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 112' ' ' LEU . 3.4 mt -123.11 104.92 9.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.891 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.476 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -59.88 133.68 56.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.656 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 120.811 0.339 . . . . 0.0 110.603 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.744 ' HB3' HD22 ' A' ' 33' ' ' LEU . 63.7 m95 -97.38 130.52 44.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.173 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.786 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -152.62 136.37 10.02 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 18.2 Cg_endo -57.37 179.91 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.866 2.377 . . . . 0.0 112.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.538 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.7 Cg_exo -63.91 117.09 4.11 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.644 2.229 . . . . 0.0 112.543 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.82 128.91 55.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.408 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.472 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -117.36 173.37 14.72 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.351 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -109.99 103.63 12.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.914 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.633 HG13 ' HB3' ' A' ' 9' ' ' ARG . 2.1 p -86.7 121.91 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.919 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.509 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 1.5 tt0 -93.73 154.01 41.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.971 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.509 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 3.4 Cg_exo -42.4 -46.44 7.72 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.745 2.297 . . . . 0.0 112.35 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.458 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.64 -11.46 82.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.107 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -85.29 164.33 18.08 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.855 0.327 . . . . 0.0 110.969 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.851 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 25.1 t70 -85.08 159.24 20.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.208 0.528 . . . . 0.0 110.772 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.412 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 21.3 m-20 -71.42 -66.42 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.618 HD21 HG21 ' A' ' 77' ' ' ILE . 12.1 tp -59.23 -40.44 85.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.279 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.85 -50.54 45.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.856 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.575 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.3 m -55.47 -36.05 66.18 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -75.84 -32.67 59.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.758 178.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.669 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.7 mt -73.37 -53.28 11.13 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.044 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -57.9 -43.66 86.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.147 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.79 -34.66 73.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.582 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.853 HG23 HD11 ' A' ' 15' ' ' ILE . 28.4 m -59.39 -53.63 55.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.521 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 4.9 pt20 -74.12 -21.44 59.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.17 -35.82 41.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 110.968 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.429 ' HB3' HD13 ' A' ' 34' ' ' LEU . 8.1 mt-10 -112.24 6.63 19.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.85 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -151.49 -12.15 0.21 Allowed 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.497 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 77.64 -2.76 62.24 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.29 -0.957 . . . . 0.0 112.784 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.619 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.9 mt -100.38 124.77 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.905 0.384 . . . . 0.0 110.831 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -108.58 167.05 10.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.767 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -45.85 -38.54 7.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.648 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.38 -20.53 73.56 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.241 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.421 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.5 tp60 -96.59 -5.68 38.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.519 0.199 . . . . 0.0 111.021 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.08 -168.81 2.15 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.906 0.384 . . . . 0.0 110.369 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.499 ' H ' ' H ' ' A' ' 102' ' ' GLU . 87.7 m -137.11 100.74 4.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.654 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 57' ' ' LEU . 8.1 mm -72.94 125.27 31.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.962 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.491 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.62 133.38 29.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.292 0.568 . . . . 0.0 111.41 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.16 151.92 20.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.205 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 99.76 -22.24 41.33 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.657 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.879 ' CE1' HD21 ' A' ' 100' ' ' LEU . 14.2 t80 -106.03 131.7 53.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 110.911 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.507 ' HD2' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.25 131.92 8.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.232 0.539 . . . . 0.0 111.109 179.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -159.39 139.32 11.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.081 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.906 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -126.39 134.27 51.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.913 0.387 . . . . 0.0 111.359 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.877 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.4 mt -93.18 118.74 31.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.98 125.67 53.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.858 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.456 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 22.2 p90 -166.85 142.67 4.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.844 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.576 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.4 p -81.73 112.34 19.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.019 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.4 -107.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -35.84 78.92 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.928 0.394 . . . . 0.0 110.748 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.93 28.55 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.857 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.741 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.9 tppt? -158.53 125.95 2.69 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.99 0.424 . . . . 0.0 111.321 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.769 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.2 Cg_endo -70.16 116.59 4.67 Favored 'Trans proline' 0 CA--C 1.513 -0.555 0 C-N-CA 123.358 2.706 . . . . 0.0 113.096 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.909 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -99.84 123.17 43.82 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.267 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.3 m -88.6 114.18 24.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.664 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.0 t -112.85 108.19 24.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.901 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.906 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.29 128.6 39.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.602 ' HB3' HG13 ' A' ' 14' ' ' ILE . 20.3 m-85 -117.95 128.58 54.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.241 0.543 . . . . 0.0 112.269 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.507 ' NE1' ' HD2' ' A' ' 82' ' ' LYS . 17.7 m-90 -109.99 167.48 10.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.579 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.879 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -103.03 110.91 23.0 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.537 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -118.23 154.49 32.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.499 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tt0 -130.97 115.24 16.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.726 HG12 HD23 ' A' ' 75' ' ' LEU . 5.3 m -73.97 122.2 26.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 121.345 0.593 . . . . 0.0 111.273 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -24.12 66.25 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.166 -178.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.772 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.5 t0 -104.44 117.9 35.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.081 0.467 . . . . 0.0 112.041 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -57.62 -42.81 84.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.0 25.24 8.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.904 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -44.06 142.54 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.869 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -63.53 142.45 58.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.252 0.549 . . . . 0.0 111.422 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.808 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.5 mm -121.05 97.4 4.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.503 179.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.497 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 8.3 mtp180 -102.17 101.69 12.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.88 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 34' ' ' LEU . 10.1 mt -90.73 178.72 5.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.353 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.66 -158.27 0.85 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.996 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -78.73 -3.45 44.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.4 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.78 -22.47 20.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.657 0.265 . . . . 0.0 111.104 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.37 116.71 17.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.41 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -87.57 -3.49 58.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.913 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -168.72 164.37 12.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 0.0 111.4 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.808 ' CD1' HG21 ' A' ' 110' ' ' ILE . 41.0 p90 -141.33 168.12 20.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.625 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.435 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 6.1 mtt180 -156.45 159.76 38.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.452 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.1 m95 -124.26 107.64 11.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.638 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -136.33 172.74 12.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.98 0.419 . . . . 0.0 111.342 -178.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.56 -153.99 7.29 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.959 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.9 tp -77.21 -42.41 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.649 0.261 . . . . 0.0 111.157 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.5 pt-20 -60.81 -50.08 74.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.316 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.82 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.22 -46.9 54.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.651 -179.401 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.535 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.03 -30.65 48.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.414 0.626 . . . . 0.0 109.636 178.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.5 m -83.71 -34.45 24.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.52 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.82 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.04 -41.44 99.5 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 121.091 0.472 . . . . 0.0 109.938 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.594 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.1 mt -77.89 -45.88 22.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.129 179.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.489 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.0 53.74 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.437 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.18 -31.49 0.05 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.585 -179.571 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -57.19 115.94 2.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.13 0.49 . . . . 0.0 110.412 179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.85 -40.01 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.473 -179.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.877 ' HB3' HD13 ' A' ' 85' ' ' LEU . 41.8 mp0 -58.1 -54.08 50.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.72 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.786 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -63.42 -39.65 95.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.749 0.309 . . . . 0.0 110.489 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.79 -37.95 60.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.19 -46.01 36.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.946 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 1.029 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.25 -45.98 62.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.211 0.529 . . . . 0.0 110.314 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.631 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.52 -29.78 59.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.045 179.012 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.578 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.54 -51.33 60.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.792 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.56 -29.67 67.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.61 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.8 -44.94 94.04 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.986 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.431 ' NE2' HD12 ' A' ' 29' ' ' ILE . 10.4 t-80 -78.78 -30.81 45.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -64.76 -52.36 57.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -61.56 -53.55 54.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.819 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.491 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.7 mt -56.02 -24.79 41.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.574 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.61 -10.93 56.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.532 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.871 179.623 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.826 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.516 -0.35 0 CA-C-O 121.696 0.76 . . . . 0.0 112.124 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.761 HD12 ' N ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.29 145.99 42.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.132 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.637 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.3 ttt85 -78.82 118.92 21.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.592 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.919 ' HB2' ' CE ' ' A' ' 94' ' ' LYS . . . -127.3 166.64 17.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.058 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -159.24 123.84 4.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.078 0.466 . . . . 0.0 111.762 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.489 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -120.61 171.92 14.87 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.496 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.773 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -125.36 118.18 25.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 117.07 0.435 . . . . 0.0 111.976 -179.171 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.93 HD11 ' HB1' ' A' ' 139' ' ' ALA . 48.6 mt -86.24 91.74 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.985 HD11 HG23 ' A' ' 64' ' ' THR . 30.3 mt -78.88 142.82 13.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.049 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.0 p90 -145.52 121.33 10.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.329 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.451 ' HG2' ' CD1' ' A' ' 106' ' ' TYR . 20.3 tpt180 -81.0 113.34 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.916 0.389 . . . . 0.0 110.075 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.666 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.929 0.395 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.72 HD12 ' NE2' ' A' ' 144' ' ' HIS . 6.5 mt -115.93 141.61 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.976 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -128.84 141.77 51.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.991 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.7 m-85 -103.52 145.41 30.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.979 0.419 . . . . 0.0 111.843 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.549 HD23 HD12 ' A' ' 15' ' ' ILE . 52.1 tp -78.2 135.41 37.61 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.112 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' HB3' ' A' ' 43' ' ' TRP . 6.2 mt -134.23 145.4 49.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.002 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 112' ' ' LEU . 6.6 mt -123.16 113.46 18.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.088 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.469 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.0 tt0 -76.64 147.69 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.559 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.092 179.762 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.843 0.354 . . . . 0.0 110.631 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 130' ' ' LEU . 65.7 m95 -102.12 135.02 44.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.8 153.38 27.47 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.6 172.88 15.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.73 2.287 . . . . 0.0 112.42 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.6 ' HG3' HD11 ' A' ' 34' ' ' LEU . 15.9 Cg_exo -66.11 86.58 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.617 2.211 . . . . 0.0 112.463 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 3.6 pttt -99.95 146.75 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.935 0.397 . . . . 0.0 110.892 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.28 -173.78 13.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.603 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 m80 -112.95 99.19 7.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.643 0.259 . . . . 0.0 110.72 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.719 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -67.01 130.54 32.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.048 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' N ' ' A' ' 52' ' ' PRO . 2.0 tt0 -96.93 151.11 37.56 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.243 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.462 ' N ' ' HG2' ' A' ' 51' ' ' GLU . 82.2 Cg_exo -39.63 -62.36 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.818 2.345 . . . . 0.0 112.463 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.31 -19.0 63.74 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.535 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -79.96 158.92 26.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.799 0.333 . . . . 0.0 110.657 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.862 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 6.0 t70 -83.33 163.26 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.289 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.506 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -71.86 -64.39 0.94 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.154 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 26.5 tp -62.3 -42.88 99.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.418 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.862 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -49.15 -45.68 44.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.758 0.314 . . . . 0.0 110.497 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.719 HG21 ' N ' ' A' ' 50' ' ' VAL . 84.9 m -55.81 -45.19 78.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.125 0.488 . . . . 0.0 109.889 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.51 -28.87 65.29 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.22 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.976 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.6 mt -72.78 -52.46 14.9 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.056 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -57.17 -46.89 82.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.779 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.03 -33.93 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 0.0 110.224 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.985 HG23 HD11 ' A' ' 15' ' ' ILE . 34.0 m -60.13 -52.31 65.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.506 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.521 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -79.19 -22.89 44.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.305 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -78.72 -36.63 43.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.688 0.28 . . . . 0.0 111.207 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 4.5 mm-40 -103.21 -18.09 15.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.721 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.641 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -125.04 -11.92 7.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.67 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 82.24 -10.78 52.8 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 119.85 -1.167 . . . . 0.0 112.423 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.787 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -96.6 122.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 21.0 pm0 -105.64 171.53 7.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.088 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.976 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.59 -34.79 18.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.459 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -16.09 77.32 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.4 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.543 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.2 mm-40 -100.12 -10.57 21.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.547 0.213 . . . . 0.0 110.88 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.32 -169.4 2.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.85 0.357 . . . . 0.0 110.276 179.286 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.9 m -135.76 100.64 4.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.114 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.668 HD13 ' HB2' ' A' ' 101' ' ' ALA . 11.3 mm -74.13 114.17 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.12 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.553 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -78.19 138.68 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 121.09 0.471 . . . . 0.0 110.826 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -95.54 149.4 21.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.0 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.22 -22.07 33.9 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.247 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.632 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.2 t80 -106.64 127.82 53.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.767 0.317 . . . . 0.0 111.16 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.413 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.94 127.88 6.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 111.73 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -151.74 138.61 18.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.8 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -119.8 123.62 44.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.946 0.403 . . . . 0.0 111.481 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 135' ' ' GLU . 9.0 mt -91.08 116.19 28.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.668 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.9 p30 -117.06 130.54 56.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.125 0.488 . . . . 0.0 110.719 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.532 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 18.4 p90 -166.86 139.24 3.52 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.795 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.819 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 8.7 p -81.1 116.14 24.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.34 0.591 . . . . 0.0 111.259 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -73.63 -92.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.066 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -46.08 13.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.943 0.402 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -166.7 23.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.545 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.605 ' C ' HG23 ' A' ' 88' ' ' VAL . 0.2 OUTLIER -155.77 125.66 3.26 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.707 179.804 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.826 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 39.6 Cg_endo -68.37 -173.79 0.59 Allowed 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.137 1.892 . . . . 0.0 111.649 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.919 ' CE ' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -160.56 112.53 1.94 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.353 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.494 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 89.3 m -86.89 100.93 12.92 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.706 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 47.9 t -103.51 108.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.742 -178.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.22 123.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.733 ' HB3' HG13 ' A' ' 14' ' ' ILE . 29.8 m-85 -109.79 129.02 55.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.366 0.603 . . . . 0.0 112.579 -177.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.536 ' CD2' HD13 ' A' ' 57' ' ' LEU . 7.0 m-90 -115.16 149.59 37.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.985 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.632 HD21 ' CE1' ' A' ' 81' ' ' PHE . 4.0 mt -82.83 121.88 27.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.668 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.57 135.54 48.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.5 tt0 -113.59 117.48 31.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.71 0.29 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 6.4 m -74.79 112.81 12.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.361 0.601 . . . . 0.0 110.579 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -25.78 42.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.802 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.79 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 64.0 t0 -101.06 116.41 32.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.991 0.424 . . . . 0.0 111.101 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.451 ' CD1' ' HG2' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -61.82 -42.31 98.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.105 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.49 21.37 9.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.874 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.79 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.4 p -44.57 143.05 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.243 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.401 ' HG3' ' HE ' ' A' ' 111' ' ' ARG . 2.6 pm0 -65.26 146.04 55.45 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.406 0.622 . . . . 0.0 111.221 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.787 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.83 98.58 5.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.293 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.67 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 8.9 mtt-85 -96.88 105.78 17.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.426 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.638 HD21 ' CG2' ' A' ' 110' ' ' ILE . 9.0 mt -99.63 120.87 40.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.958 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.28 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.658 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -87.63 19.36 3.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.612 0.244 . . . . 0.0 111.171 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -107.09 -43.73 4.55 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 45.3 m80 -98.24 132.6 43.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.703 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -93.03 -22.48 19.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.647 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.92 166.88 23.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 111.7 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.729 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.1 p90 -139.23 174.76 10.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.417 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 120' ' ' ARG . 0.1 OUTLIER -160.01 158.52 30.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.147 0.499 . . . . 0.0 111.624 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.404 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 85.8 m95 -123.0 106.96 11.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.62 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.34 165.27 26.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.83 -151.22 2.54 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.364 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.498 HD21 ' CD ' ' A' ' 141' ' ' GLN . 6.9 tp -76.55 -42.8 41.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.86 0.362 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -61.5 -52.49 64.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.83 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.705 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -68.92 -45.0 71.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.97 0.414 . . . . 0.0 110.615 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.16 66.36 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.266 0.555 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.52 -32.33 25.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.257 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -65.18 -44.49 88.32 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -76.23 -44.81 35.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.753 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.09 55.34 1.79 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.814 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.75 -34.2 0.14 Allowed 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.415 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.47 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 14.1 m-85 -55.92 118.18 4.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.678 -179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -45.55 -50.91 12.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.52 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.773 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.0 mp0 -46.6 -54.69 8.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.776 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.413 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -64.21 -45.21 89.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.118 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.22 -41.7 50.33 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -70.64 -47.93 57.52 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.777 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.93 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.86 -42.75 62.88 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.138 0.494 . . . . 0.0 110.307 179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.47 -31.55 42.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.95 178.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.54 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.52 -51.19 66.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.596 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.556 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -70.97 -27.63 63.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.936 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -59.05 -49.35 79.4 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.256 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.72 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.6 t-160 -74.3 -29.12 61.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.922 0.391 . . . . 0.0 110.624 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -67.41 -52.32 41.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.177 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -62.05 -53.14 59.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.21 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.553 ' CD2' HG12 ' A' ' 78' ' ' ILE . 76.6 mt -54.67 -28.34 46.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.851 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -10.95 59.71 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.866 0.365 . . . . 0.0 110.808 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.801 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.612 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.161 0 CA-C-O 121.231 0.539 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.903 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -108.24 128.13 54.45 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.096 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.566 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -79.57 116.59 19.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.658 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.514 ' HB3' ' HD3' ' A' ' 94' ' ' LYS . . . -132.78 168.82 17.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.047 0.451 . . . . 0.0 111.619 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 17.7 m -156.31 123.99 5.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.261 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.516 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.93 176.71 17.75 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.76 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.761 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.2 mt -129.96 120.87 25.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 117.237 0.519 . . . . 0.0 112.322 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.65 HD11 ' CG ' ' A' ' 98' ' ' TYR . 5.7 mm -80.63 91.77 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.928 HD11 HG23 ' A' ' 64' ' ' THR . 75.7 mt -84.88 136.7 22.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.574 -177.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.708 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 45.2 p90 -150.17 131.16 14.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.283 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.66 113.95 24.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 110.334 178.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.742 ' NH1' HD11 ' A' ' 29' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.435 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.633 0.254 . . . . 0.0 111.62 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.742 HD11 ' NH1' ' A' ' 18' ' ' ARG . 6.3 mt -109.63 144.14 18.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.477 0.656 . . . . 0.0 112.094 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.627 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.0 mm-40 -124.1 172.67 8.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.589 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 40.4 m-85 -133.46 133.94 42.91 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.688 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD23 ' CD1' ' A' ' 15' ' ' ILE . 29.8 tp -75.38 134.58 40.92 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 6.3 mt -135.06 135.43 41.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.082 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.643 HD11 ' HG3' ' A' ' 46' ' ' PRO . 38.9 mt -112.51 102.3 10.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 5.2 tm0? -61.62 134.35 56.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 111.735 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.821 179.56 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 4.8 p-80 . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.682 0.277 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.68 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 32.9 m95 -92.84 139.68 30.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.147 0.499 . . . . 0.0 111.957 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.403 ' HB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -157.9 139.12 9.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.002 179.233 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.446 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.3 Cg_endo -66.85 175.51 5.35 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.232 1.955 . . . . 0.0 112.001 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.643 ' HG3' HD11 ' A' ' 34' ' ' LEU . 32.1 Cg_exo -59.4 113.01 1.42 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.762 2.308 . . . . 0.0 112.55 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -112.5 141.44 46.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.829 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.479 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.51 167.8 21.28 Favored Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.629 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.437 ' CE1' ' HE2' ' A' ' 94' ' ' LYS . 48.8 m-70 -113.86 101.89 9.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.811 0.339 . . . . 0.0 110.706 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.59 ' N ' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -67.77 129.98 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.572 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -90.61 172.11 7.37 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.724 -179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 73.3 Cg_exo -50.03 -63.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.57 2.18 . . . . 0.0 112.733 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.03 10.38 58.14 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.292 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 16.7 tt0 -89.22 161.51 16.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.044 0.422 . . . . 0.0 110.912 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.898 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 8.6 t0 -86.81 162.94 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.763 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.495 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -75.15 -63.23 1.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.842 0.353 . . . . 0.0 111.224 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.703 HD21 HG21 ' A' ' 77' ' ' ILE . 26.8 tp -62.75 -40.89 98.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.36 -47.94 55.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.48 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.59 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.6 m -54.19 -42.61 69.92 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.16 -37.13 75.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.825 178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.879 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.2 mt -64.8 -52.7 55.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.593 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.4 tpt180 -62.87 -40.32 97.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.442 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.479 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -63.17 -32.22 73.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.06 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.928 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -65.1 -49.46 69.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.681 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.52 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -76.92 -22.88 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.877 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -79.29 -33.47 43.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.853 0.359 . . . . 0.0 111.228 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -106.74 -16.63 14.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.664 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.85 -6.81 4.51 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.501 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 75.25 -5.57 33.98 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.77 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 74' ' ' GLN . 2.8 mt -98.97 124.22 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 CA-C-N 117.013 0.407 . . . . 0.0 110.529 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 9.6 pt-20 -110.31 170.65 7.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.106 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.879 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.44 -32.51 3.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.828 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.6 -25.75 74.51 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.088 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.693 ' HB3' HG23 ' A' ' 70' ' ' ILE . 11.2 mm-40 -94.41 1.47 55.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.409 0.147 . . . . 0.0 111.146 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.39 -173.92 3.89 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.924 0.392 . . . . 0.0 110.705 178.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.556 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 42.4 m -135.93 98.15 3.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.686 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.737 HD12 HD21 ' A' ' 13' ' ' LEU . 11.5 mm -68.69 107.72 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.453 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.502 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.58 133.09 32.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 121.274 0.559 . . . . 0.0 110.715 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -90.96 150.9 21.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.212 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.19 -25.67 22.83 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.092 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.476 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.7 t80 -102.43 119.96 39.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.8 0.333 . . . . 0.0 111.091 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.524 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -149.75 124.75 9.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.275 0.559 . . . . 0.0 110.86 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -148.79 138.14 21.76 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.7 pm0 -118.25 121.06 39.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.034 0.445 . . . . 0.0 111.047 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.8 HD13 ' CB ' ' A' ' 135' ' ' GLU . 5.5 mt -85.09 123.45 30.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.35 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.416 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.2 m-80 -115.45 120.29 39.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.642 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -167.33 141.18 3.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.818 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.621 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.6 p -81.46 109.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.238 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -78.53 -100.68 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.039 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -38.58 89.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 173.64 28.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.646 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.846 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -157.02 130.15 4.49 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.495 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.903 ' O ' HD12 ' A' ' 8' ' ' LEU . 41.1 Cg_endo -65.46 120.12 7.26 Favored 'Trans proline' 0 CA--C 1.512 -0.594 0 C-N-CA 123.263 2.642 . . . . 0.0 112.368 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.524 ' HD3' HG22 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -103.74 127.24 51.23 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.859 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 69.5 m -100.12 105.14 16.73 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.682 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 52.8 t -105.48 107.72 23.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.933 -178.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.76 111.47 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CG ' HD11 ' A' ' 14' ' ' ILE . 7.4 m-85 -91.05 166.02 13.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.524 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -157.01 134.07 10.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.421 -179.552 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.526 HD13 ' HG ' ' A' ' 147' ' ' LEU . 1.3 mt -73.41 132.69 43.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.301 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.706 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -139.51 138.61 36.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.146 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.708 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.3 tt0 -108.85 109.52 20.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.895 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.767 HG12 HD23 ' A' ' 75' ' ' LEU . 6.1 m -72.49 149.86 8.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.211 0.529 . . . . 0.0 111.39 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.15 -8.18 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.933 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.469 ' O ' HG12 ' A' ' 108' ' ' VAL . 3.2 t70 -149.47 117.88 6.49 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.165 0.507 . . . . 0.0 112.238 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CA ' ' HG3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -49.68 -39.73 37.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.315 0.579 . . . . 0.0 110.365 178.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -101.54 25.0 8.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.877 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 105' ' ' ASP . 3.4 p -43.92 156.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.109 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.657 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 3.1 pm0 -60.94 139.7 57.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.274 0.559 . . . . 0.0 110.917 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.807 HG21 ' CD1' ' A' ' 119' ' ' TYR . 45.8 mm -122.14 99.52 7.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.429 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.501 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 2.4 mtt180 -102.7 96.61 6.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.317 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.728 HD21 ' CG2' ' A' ' 110' ' ' ILE . 5.6 mt -86.86 149.55 24.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.834 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.8 m -88.9 -170.14 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -71.49 -5.59 34.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.603 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.0 -24.3 18.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 110.965 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 14.8 m80 -106.52 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.642 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -123.72 -20.76 5.38 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -161.87 171.85 17.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.158 0.504 . . . . 0.0 111.857 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.807 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.1 p90 -149.43 177.73 9.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.504 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.4 mtt180 -166.6 162.91 16.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.316 0.579 . . . . 0.0 111.949 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.403 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 80.4 m95 -125.17 106.8 10.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.224 178.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.779 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -134.85 170.46 15.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 0.0 111.819 -178.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.31 -152.95 5.41 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.827 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.471 HD21 ' CD ' ' A' ' 141' ' ' GLN . 5.7 tp -77.72 -42.93 32.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.69 0.281 . . . . 0.0 111.59 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.537 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.7 pt-20 -60.69 -49.69 76.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.488 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.779 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -69.58 -52.35 26.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.93 0.395 . . . . 0.0 110.006 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.56 -28.12 8.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.382 0.611 . . . . 0.0 109.68 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.431 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 1.0 OUTLIER -83.05 -38.3 22.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.871 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.608 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -58.34 -47.73 82.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.995 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.63 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -77.16 -40.34 45.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.504 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -76.74 54.62 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.634 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.34 -35.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.822 -179.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.419 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 6.5 m-85 -58.43 120.62 9.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -46.77 -48.38 20.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.8 ' CB ' HD13 ' A' ' 85' ' ' LEU . 2.1 mp0 -51.17 -53.37 35.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.486 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.663 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -58.62 -39.52 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.057 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -56.99 -44.94 83.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.935 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -66.52 -46.55 75.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.493 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -52.52 -44.63 65.87 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.939 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.663 HD12 ' O ' ' A' ' 136' ' ' MET . 0.9 OUTLIER -80.9 -26.65 36.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.222 179.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.584 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.77 -51.81 37.1 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.723 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -74.57 -31.61 62.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.597 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.52 -48.3 60.96 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.165 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.436 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 8.2 t-80 -74.95 -32.25 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.041 0.448 . . . . 0.0 110.579 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 31.9 tp60 -64.85 -52.41 56.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.512 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -58.03 -54.16 50.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.262 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.526 ' HG ' HD13 ' A' ' 100' ' ' LEU . 72.5 mt -58.0 -32.17 67.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.857 -179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -15.99 58.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.787 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.666 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.121 0.486 . . . . 0.0 110.735 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -102.71 132.91 48.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.643 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.592 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.65 122.64 28.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.319 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -135.73 165.57 25.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.752 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.676 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 57.8 m -154.41 123.22 6.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.145 0.497 . . . . 0.0 111.236 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.409 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.41 172.41 14.27 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.535 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.834 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -126.65 117.17 22.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.018 0.409 . . . . 0.0 111.249 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.824 HD11 ' HB1' ' A' ' 139' ' ' ALA . 76.1 mt -83.95 90.84 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HG23 ' A' ' 64' ' ' THR . 43.2 mt -80.71 145.45 8.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.77 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 47.6 p90 -149.84 122.14 8.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.302 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.795 ' HD3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -81.54 112.9 19.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.274 179.268 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 120.796 0.332 . . . . 0.0 111.419 -179.676 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.19 0 CA-C-O 120.822 0.344 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.7 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.4 mt -107.82 143.12 18.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.254 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 1.4 mt-10 -134.7 124.94 26.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.034 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.7 m-85 -89.66 144.6 25.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.65 HD23 HD12 ' A' ' 15' ' ' ILE . 43.1 tp -86.1 131.13 34.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.777 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.528 HD12 ' CD1' ' A' ' 122' ' ' LEU . 6.6 mt -129.69 140.16 51.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.618 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.498 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.7 mt -119.75 103.99 9.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.806 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 49.2 tt0 -57.85 119.79 7.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.409 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 179.716 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.474 ' CE1' HG21 ' A' ' 44' ' ' THR . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.573 0.225 . . . . 0.0 110.605 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 48.9 m95 -108.13 110.19 21.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.844 0.355 . . . . 0.0 111.264 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.474 HG21 ' CE1' ' A' ' 42' ' ' HIS . 53.7 p -128.93 130.6 23.45 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.102 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.56 179.57 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.47 2.113 . . . . 0.0 112.102 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.638 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.6 Cg_exo -54.23 99.96 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.122 1.881 . . . . 0.0 112.093 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -99.34 140.83 32.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.862 0.363 . . . . 0.0 110.927 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.33 164.55 26.56 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.381 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -102.4 111.67 24.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.628 0.251 . . . . 0.0 110.582 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.592 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -86.45 134.34 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.447 0.641 . . . . 0.0 111.291 -179.681 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.786 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 9.0 tt0 -90.64 150.47 42.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.122 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.14 -23.37 22.22 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.761 2.307 . . . . 0.0 112.972 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.786 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.66 -11.24 38.58 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.509 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -84.66 166.51 17.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.894 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.4 t70 -80.35 159.0 25.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.214 0.531 . . . . 0.0 110.263 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.55 -66.39 0.63 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.734 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.634 HD21 HG21 ' A' ' 77' ' ' ILE . 30.9 tp -63.12 -38.06 89.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.437 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.894 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.84 -50.48 45.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.708 0.289 . . . . 0.0 110.498 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.47 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 53.9 m -54.62 -45.89 73.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 109.938 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.676 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -66.41 -29.21 69.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.184 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.964 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -74.6 -52.3 12.13 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.466 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -43.71 90.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.416 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.05 -32.83 72.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.388 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.862 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -61.55 -52.77 63.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.466 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.455 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.1 tt0 -75.06 -23.0 58.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.4 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -79.49 -40.05 30.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.877 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 5.5 mm-40 -104.16 1.41 30.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.095 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -147.13 -12.44 0.42 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.598 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 78.87 -7.91 47.41 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.779 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.821 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.8 mt -96.32 122.49 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.529 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 6.0 pt-20 -104.48 167.42 9.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.964 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.23 -35.76 8.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.526 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.08 -23.77 76.04 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.018 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.464 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 3.6 tp60 -94.96 -5.65 44.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.793 0.33 . . . . 0.0 111.198 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.923 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.51 -170.99 2.54 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.443 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.526 ' H ' ' H ' ' A' ' 102' ' ' GLU . 35.7 m -137.75 100.86 4.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.691 HD12 HD21 ' A' ' 13' ' ' LEU . 13.3 mm -73.15 109.76 5.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.188 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.556 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -71.63 136.22 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.962 0.411 . . . . 0.0 110.427 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -93.72 149.74 20.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.511 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.0 -15.96 54.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.528 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.71 ' CD2' HD11 ' A' ' 100' ' ' LEU . 18.9 t80 -104.78 135.62 45.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.76 0.315 . . . . 0.0 111.24 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.608 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.99 138.1 12.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.126 0.488 . . . . 0.0 111.437 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 142.78 5.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.347 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.846 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.5 pm0 -132.51 127.34 34.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.903 0.382 . . . . 0.0 111.176 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.024 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.3 mt -90.55 117.31 29.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.433 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -113.96 126.56 55.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.774 -178.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 22.3 p90 -167.71 141.58 3.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.01 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.616 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.6 p -84.97 111.88 21.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.136 0.493 . . . . 0.0 110.246 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.26 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.442 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -80.0 -37.69 33.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.825 0.345 . . . . 0.0 110.704 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.67 26.99 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.169 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.689 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.62 122.09 2.66 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-O 120.899 0.381 . . . . 0.0 110.896 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.0 Cg_endo -71.68 118.21 5.53 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.223 2.615 . . . . 0.0 112.945 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.728 ' HD3' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -96.76 124.37 40.72 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.069 -179.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.513 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 88.7 m -94.14 110.25 21.98 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.5 t -109.89 107.57 23.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.386 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.846 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.62 128.74 39.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 14' ' ' ILE . 26.2 m-85 -114.07 136.39 52.97 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.608 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.5 m-90 -123.37 146.07 48.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.128 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.71 HD11 ' CD2' ' A' ' 81' ' ' PHE . 3.1 mt -78.63 125.97 30.1 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -132.67 147.71 52.34 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.687 0.28 . . . . 0.0 111.388 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.526 ' H ' ' H ' ' A' ' 76' ' ' THR . 7.5 tt0 -126.37 111.95 15.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.748 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.729 HG12 HD23 ' A' ' 75' ' ' LEU . 6.2 m -72.08 130.16 35.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.294 0.569 . . . . 0.0 110.81 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.55 -23.88 67.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.395 -177.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 5.7 t70 -107.13 130.23 54.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.074 0.464 . . . . 0.0 112.205 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.795 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 11.2 t80 -66.67 -37.08 84.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.931 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.61 26.4 10.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.064 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.8 p -43.8 146.86 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.925 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -71.3 142.55 50.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.344 0.592 . . . . 0.0 111.252 -179.166 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.821 ' CD1' HD11 ' A' ' 70' ' ' ILE . 43.0 mm -119.64 98.72 6.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.365 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.598 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 1.3 mtp85 -95.7 102.77 14.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.217 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.714 HD11 ' HD1' ' A' ' 119' ' ' TYR . 11.6 mt -100.24 139.85 35.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.804 179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.9 p -94.89 -154.94 0.44 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.601 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 19.12 1.06 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.521 0.201 . . . . 0.0 111.249 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -35.25 8.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.776 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.451 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 81.0 m-70 -117.74 139.78 50.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.968 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -92.92 -16.18 25.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.247 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.42 177.35 3.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 111.332 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.776 ' CD1' HG21 ' A' ' 110' ' ' ILE . 49.5 p90 -148.2 169.71 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.756 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.43 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -159.18 153.48 23.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.159 0.504 . . . . 0.0 111.746 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -114.49 107.08 15.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.507 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.24 167.55 21.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.489 -178.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -152.56 3.73 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.636 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.2 tp -76.96 -45.47 27.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.929 0.365 . . . . 0.0 110.967 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.6 pt-20 -56.99 -51.34 69.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.489 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.798 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.74 -46.74 62.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.938 0.399 . . . . 0.0 110.539 -179.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.589 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -55.66 -30.62 61.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.262 0.553 . . . . 0.0 109.635 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 3.1 m -84.26 -29.7 26.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.433 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.798 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.18 -42.67 88.56 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.979 0.419 . . . . 0.0 110.719 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -77.57 -45.1 26.34 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.762 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.953 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.6 56.68 2.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.502 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -34.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.152 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.439 ' O ' ' HD3' ' A' ' 137' ' ' LYS . 10.0 m-85 -58.82 123.85 17.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.81 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.53 -54.67 7.21 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 1.024 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -44.77 -57.88 3.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.918 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.953 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.26 -36.5 75.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.009 0.433 . . . . 0.0 110.575 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.439 ' HD3' ' O ' ' A' ' 133' ' ' PHE . 0.0 OUTLIER -62.7 -37.88 88.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.923 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.59 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.84 -45.6 67.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.578 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.824 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.23 -44.92 65.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.246 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.589 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -78.25 -29.64 48.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.016 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.59 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -62.28 -51.67 66.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.165 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -70.49 -30.03 66.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.716 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.7 -51.65 43.11 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -77.34 -29.2 53.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.86 0.362 . . . . 0.0 110.659 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.23 -52.51 54.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.008 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -60.6 -54.75 41.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.8 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.478 ' CD2' HG12 ' A' ' 78' ' ' ILE . 90.0 mt -54.73 -36.84 65.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.619 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 19.3 t -66.14 -13.16 59.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.063 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.37 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 121.26 0.552 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.65 139.88 41.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.563 179.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.695 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.37 118.18 23.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.982 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -129.81 165.67 21.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.977 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 11.2 m -157.79 123.94 4.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.203 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.619 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.2 172.91 14.62 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.182 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.775 HD12 ' OG1' ' A' ' 64' ' ' THR . 2.1 mt -125.83 117.74 24.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.764 0.316 . . . . 0.0 111.386 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.782 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.9 mt -85.3 91.0 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.835 HD11 HG23 ' A' ' 64' ' ' THR . 64.6 mt -79.13 139.86 17.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.096 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.615 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.4 p90 -144.13 121.16 11.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.41 -178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.866 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -87.34 118.59 26.88 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.69 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.6 ttm-85 . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.458 -179.219 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.806 0.336 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.615 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.5 mt -110.89 143.17 21.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.219 0.533 . . . . 0.0 111.791 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 11.7 mp0 -131.25 138.01 49.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.712 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.613 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.0 m-85 -101.38 152.23 20.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.047 0.451 . . . . 0.0 112.047 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.73 HD23 HD12 ' A' ' 15' ' ' ILE . 45.7 tp -86.72 138.51 31.57 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.96 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.3 mt -137.72 139.69 40.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.889 0.376 . . . . 0.0 111.006 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.811 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.4 mt -119.2 109.3 15.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.127 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.0 tt0 -64.78 140.78 58.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.075 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.169 179.19 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.973 0.416 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' A' ' 35' ' ' GLN . 40.1 m95 -98.63 145.1 27.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.663 -179.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.437 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.1 OUTLIER -161.62 149.61 12.33 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.656 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.538 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 38.4 Cg_endo -65.01 166.69 17.86 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.535 2.157 . . . . 0.0 111.974 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.811 ' HG3' HD11 ' A' ' 34' ' ' LEU . 18.1 Cg_exo -66.51 87.88 0.27 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.64 2.227 . . . . 0.0 112.519 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.619 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.6 pttt -98.81 145.32 27.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.42 -166.04 12.02 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.879 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -119.51 102.49 8.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.624 0.25 . . . . 0.0 111.021 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.742 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -76.74 122.05 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.898 0.38 . . . . 0.0 110.752 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -78.12 172.81 8.85 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.768 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 52.6 Cg_exo -54.62 -56.47 2.43 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.387 2.058 . . . . 0.0 112.305 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.08 14.3 61.01 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.974 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.502 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 71.0 tt0 -94.22 158.96 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.863 0.332 . . . . 0.0 110.661 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.0 t70 -79.37 159.47 27.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.65 -58.87 3.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.347 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.496 ' CD2' HG21 ' A' ' 77' ' ' ILE . 37.1 tp -65.74 -39.79 91.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.84 0.352 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.965 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.45 -49.98 53.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.442 179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.742 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.9 m -54.34 -42.79 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.491 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.97 -30.56 66.86 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.098 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 1.057 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.5 mt -71.16 -52.68 17.87 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.69 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 ttp85 -60.73 -41.32 95.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.478 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.659 ' HB1' ' OE1' ' A' ' 67' ' ' GLU . . . -62.09 -31.83 72.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.116 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.835 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -64.9 -49.9 68.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.432 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -77.43 -26.27 51.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.74 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -79.34 -35.9 40.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.822 0.344 . . . . 0.0 111.023 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.659 ' OE1' ' HB1' ' A' ' 63' ' ' ALA . 2.3 mp0 -106.75 0.92 24.53 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.733 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.3 -7.12 0.41 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.583 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 73.64 -4.87 26.01 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.056 -1.069 . . . . 0.0 113.121 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.8 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.5 mt -100.09 126.75 53.52 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.08 0 CA-C-N 117.214 0.507 . . . . 0.0 110.503 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.505 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.0 pt-20 -109.02 169.55 8.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.424 . . . . 0.0 111.722 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 1.057 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.86 -35.55 10.54 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.818 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.19 -22.06 78.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.131 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.462 ' HB3' HG22 ' A' ' 70' ' ' ILE . 6.6 tp60 -97.31 0.85 48.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.494 0.187 . . . . 0.0 111.397 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.808 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.28 -176.51 4.74 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.117 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.602 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 65.5 m -132.45 100.48 4.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 111.463 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.655 HD12 HD21 ' A' ' 13' ' ' LEU . 9.7 mm -70.17 119.06 15.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.803 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.51 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.59 134.38 27.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.148 0.499 . . . . 0.0 111.113 -179.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -93.79 150.97 19.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.312 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.13 -22.96 37.82 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.332 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.861 ' CE1' HD21 ' A' ' 100' ' ' LEU . 19.0 t80 -105.75 126.04 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.579 0.228 . . . . 0.0 110.847 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.506 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 2.2 ttpt -157.55 126.74 5.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.159 0.504 . . . . 0.0 111.615 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.09 139.43 22.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.845 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -122.29 137.81 54.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.111 0.481 . . . . 0.0 111.55 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.005 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.0 mt -103.75 120.7 41.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.583 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -110.95 127.7 55.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.778 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.433 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 26.5 p90 -166.95 141.72 4.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.929 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.0 p -85.35 112.87 22.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.836 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -77.16 -95.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.525 -178.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.81 -37.32 64.92 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-O 120.841 0.353 . . . . 0.0 110.712 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.0 t-20 178.21 26.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.105 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.712 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.01 124.4 3.4 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.049 179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 67.6 Cg_endo -74.2 118.91 5.57 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 123.145 2.563 . . . . 0.0 112.376 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.4 ttpt -103.59 126.36 50.68 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.616 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.9 m -87.62 107.29 18.54 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 18.4 t -105.52 108.31 24.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.026 -178.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -86.24 129.51 38.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.634 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.8 m-85 -113.63 131.98 55.93 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.506 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.3 m-90 -119.58 140.69 50.16 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.774 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.861 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -77.67 133.11 38.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.645 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -142.03 140.93 32.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.795 0.331 . . . . 0.0 111.541 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 8.4 tt0 -113.15 111.6 22.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.721 HG12 HD23 ' A' ' 75' ' ' LEU . 7.0 m -71.61 151.06 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.339 0.59 . . . . 0.0 111.65 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -75.7 -7.6 54.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.927 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.574 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 9.7 t70 -143.89 115.1 7.95 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-O 121.154 0.502 . . . . 0.0 112.349 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.866 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 0.4 OUTLIER -49.35 -40.21 34.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.694 178.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -102.95 24.72 10.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.793 178.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.574 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.3 p -43.52 151.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.667 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 2.6 pm0 -61.24 138.78 58.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.346 0.593 . . . . 0.0 110.193 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.816 HG21 ' CG ' ' A' ' 119' ' ' TYR . 33.6 mm -121.87 98.07 5.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.295 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.583 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 21.6 mtp180 -97.1 105.64 17.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.196 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 13.7 mt -92.21 155.49 17.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 111.371 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.07 -168.06 1.54 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.641 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -67.1 -18.5 65.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.442 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -84.3 -14.24 50.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.652 0.263 . . . . 0.0 111.521 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 92.7 m-70 -117.99 164.26 15.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.967 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -138.56 -28.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.715 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.8 158.6 37.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.93 0.395 . . . . 0.0 111.619 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.816 ' CG ' HG21 ' A' ' 110' ' ' ILE . 44.4 p90 -135.81 173.51 11.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.446 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.481 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 13.6 mtt85 -156.64 156.42 33.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.304 0.573 . . . . 0.0 111.671 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -120.49 107.17 12.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.659 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.59 170.51 15.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.998 0.428 . . . . 0.0 111.714 -178.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.39 -159.8 20.96 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.147 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.526 HD21 ' CD ' ' A' ' 141' ' ' GLN . 7.4 tp -69.61 -41.32 75.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.709 0.29 . . . . 0.0 111.475 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.0 pt-20 -62.87 -51.06 68.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.587 -179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.673 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.42 -51.2 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.838 0.351 . . . . 0.0 110.494 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -51.1 -31.1 18.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.261 0.553 . . . . 0.0 109.638 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 7.0 m -83.39 -29.11 28.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.295 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.548 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -66.91 -45.18 78.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.548 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -75.23 -43.46 51.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.69 51.67 1.11 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.911 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.42 -33.57 0.1 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.527 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.472 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.6 m-85 -55.79 118.54 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.329 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.72 -50.84 13.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 1.005 ' HB3' HD13 ' A' ' 85' ' ' LEU . 17.3 mp0 -46.94 -51.02 17.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.021 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.625 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -67.4 -39.96 85.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.72 0.295 . . . . 0.0 111.139 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -54.64 -33.98 61.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.092 179.328 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.52 -45.41 21.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.652 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.782 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.98 -48.15 64.51 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.395 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.25 -26.65 59.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.245 179.107 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.43 -51.93 38.34 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.967 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.498 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 5.1 mp0 -69.27 -28.97 66.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.251 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.542 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.83 -43.29 99.41 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.719 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -75.91 -27.75 57.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -70.94 -52.47 19.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.355 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.71 -53.83 53.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 83.4 mt -54.77 -29.4 53.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.594 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -13.42 62.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.729 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.308 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.64 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.19 0 CA-C-O 121.137 0.494 . . . . 0.0 111.694 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.827 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -114.14 141.67 47.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.732 -179.765 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.863 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -80.66 126.56 31.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.773 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.925 ' HB2' ' HE2' ' A' ' 94' ' ' LYS . . . -137.72 161.62 36.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -156.44 123.08 5.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.17 0.51 . . . . 0.0 111.288 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.477 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.69 176.99 17.24 Favored Glycine 0 N--CA 1.446 -0.633 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.201 178.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.803 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -130.71 117.64 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.139 0.47 . . . . 0.0 111.177 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 98' ' ' TYR . 39.5 mt -84.13 90.3 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.647 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.946 HD11 HG23 ' A' ' 64' ' ' THR . 83.2 mt -79.93 145.36 9.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.413 -178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 47.9 p90 -152.6 127.72 9.76 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.124 -178.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -96.76 113.69 25.27 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.692 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.483 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.827 0.346 . . . . 0.0 111.408 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.769 HD12 ' NE2' ' A' ' 144' ' ' HIS . 4.0 mt -106.15 150.85 8.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.42 0.628 . . . . 0.0 111.713 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.58 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 37.4 mm-40 -120.72 173.5 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.033 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 21.9 m-85 -141.37 128.75 21.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.598 0.237 . . . . 0.0 111.218 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 HD12 ' A' ' 15' ' ' ILE . 39.6 tp -73.0 140.45 47.34 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.614 HD11 ' HA ' ' A' ' 127' ' ' ALA . 8.0 mt -139.91 145.32 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.972 0.415 . . . . 0.0 111.074 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 112' ' ' LEU . 7.9 mt -123.77 112.22 17.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.238 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt0 -72.09 147.78 46.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.204 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.228 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.386 -179.927 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 . . . . . 0 N--CA 1.455 -0.186 0 CA-C-O 120.749 0.309 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.597 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.4 m95 -109.63 117.83 34.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.194 0.521 . . . . 0.0 111.499 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 ' SD ' ' A' ' 136' ' ' MET . 70.7 p -140.86 145.3 39.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.195 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LEU . 32.2 Cg_exo -57.7 170.71 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.995 1.797 . . . . 0.0 111.452 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.558 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 53.6 Cg_exo -52.03 95.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.328 2.019 . . . . 0.0 112.541 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER -88.55 130.08 35.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.727 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -143.78 123.72 2.11 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.612 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.688 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 7.0 p80 -67.31 120.21 13.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.509 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.863 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -83.32 140.09 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.122 0.487 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.708 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 5.6 tt0 -91.76 149.49 39.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.93 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.7 Cg_endo -55.27 -20.82 26.39 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.958 2.438 . . . . 0.0 113.355 -178.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.682 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.56 -11.68 43.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.619 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -90.56 168.56 11.72 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.027 0.442 . . . . 0.0 110.911 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.801 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.1 t70 -81.76 160.79 23.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.463 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -69.21 -66.93 0.52 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.578 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD21 HG21 ' A' ' 77' ' ' ILE . 29.1 tp -62.21 -38.04 87.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.166 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.801 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -51.08 -46.82 61.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.721 -179.705 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.53 HG21 ' CA ' ' A' ' 50' ' ' VAL . 95.9 m -55.83 -46.46 78.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -65.4 -31.77 73.04 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.981 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.775 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.1 mt -72.14 -52.32 17.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.464 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 12.2 ttt-85 -62.41 -36.85 83.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.841 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.06 -31.65 72.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.946 HG23 HD11 ' A' ' 15' ' ' ILE . 24.4 m -62.51 -52.31 63.99 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.526 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -74.43 -24.38 59.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.739 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.6 -36.67 37.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.816 0.341 . . . . 0.0 110.597 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.69 10.58 22.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.683 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -158.53 -4.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.597 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 67.41 2.13 18.77 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.342 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.753 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -104.28 125.75 59.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 117.085 0.442 . . . . 0.0 110.363 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -107.94 170.44 7.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.282 -179.435 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.851 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.69 -31.63 7.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.212 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.38 -26.41 74.21 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.889 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.559 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 1.2 mm-40 -96.25 2.17 52.7 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -140.79 -179.15 5.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.047 0.451 . . . . 0.0 110.465 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.1 m -131.59 100.1 5.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.124 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.719 HD12 HD21 ' A' ' 13' ' ' LEU . 11.1 mm -71.1 112.29 5.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.022 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.572 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.18 134.07 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.026 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -93.16 150.93 20.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.74 39.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.16 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.683 ' CD1' HD21 ' A' ' 100' ' ' LEU . 21.1 t80 -104.41 123.49 47.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 110.607 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.47 128.69 6.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.276 0.56 . . . . 0.0 111.663 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -158.38 142.71 15.87 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.415 179.255 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.836 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -120.07 133.18 55.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.073 0.464 . . . . 0.0 111.93 -179.343 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.949 HD13 ' HB2' ' A' ' 135' ' ' GLU . 13.5 mt -97.53 116.19 29.27 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.731 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.2 p30 -115.53 133.34 56.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 111.506 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.406 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.2 p90 -166.74 140.07 3.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.64 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.671 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.9 p -81.26 107.19 13.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.338 0.59 . . . . 0.0 110.361 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.32 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.777 -178.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.0 57.37 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.309 . . . . 0.0 110.992 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 171.84 29.19 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.684 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.796 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.1 tptt -158.84 123.63 2.23 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.269 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.827 ' O ' HD12 ' A' ' 8' ' ' LEU . 33.3 Cg_endo -67.9 121.1 8.1 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.988 2.459 . . . . 0.0 113.245 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.925 ' HE2' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.87 113.62 25.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.806 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.3 m -87.76 105.5 17.43 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.693 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 39.5 t -108.03 108.38 25.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.836 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.13 122.54 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.583 ' HB3' HG13 ' A' ' 14' ' ' ILE . 40.4 m-85 -102.92 147.16 27.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -177.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.553 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.1 m-90 -135.07 138.39 43.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.347 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.683 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -74.55 135.43 42.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.523 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -139.75 139.11 36.4 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 120.777 0.322 . . . . 0.0 111.796 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.644 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 13.3 tt0 -113.09 107.94 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.256 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.67 HG12 HD23 ' A' ' 75' ' ' LEU . 9.0 m -72.1 139.76 19.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 121.329 0.585 . . . . 0.0 111.574 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 2.7 mptp? -69.25 -18.22 63.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.511 -178.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.669 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 18.8 t0 -124.25 127.77 48.18 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.532 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 t80 -60.65 -45.09 95.44 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.984 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -98.02 23.9 7.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.074 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.1 p -42.26 143.75 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.136 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -61.05 142.09 56.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.303 0.573 . . . . 0.0 111.144 -178.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.753 ' CD1' HD11 ' A' ' 70' ' ' ILE . 28.7 mm -124.55 96.46 3.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.093 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.597 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 1.4 mtt180 -98.88 102.53 14.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.666 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.499 HD21 ' CG2' ' A' ' 110' ' ' ILE . 11.0 mt -88.61 -178.59 5.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.6 m -127.45 -168.13 1.84 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.275 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.43 -13.42 62.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.578 0.214 . . . . 0.0 111.578 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.84 -18.88 29.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.35 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.439 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 98.5 m-70 -131.04 123.36 28.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.483 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.95 0.5 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.115 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.16 160.2 6.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.937 0.399 . . . . 0.0 111.612 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.747 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.7 p90 -142.03 174.36 10.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.744 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.404 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 15.4 mtt180 -159.46 159.69 33.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.262 0.553 . . . . 0.0 111.784 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.402 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 83.3 m95 -121.45 107.26 12.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.787 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -141.09 168.33 20.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 111.829 -178.639 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.48 -151.77 4.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.908 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 141' ' ' GLN . 15.5 tp -76.91 -49.06 16.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.778 0.323 . . . . 0.0 111.151 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -52.53 -52.09 56.43 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.614 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.818 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -69.57 -51.25 37.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.079 0.466 . . . . 0.0 110.436 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.614 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.93 -29.28 19.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.032 178.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.7 m -84.36 -33.86 23.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.49 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.818 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.67 -42.9 95.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.954 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -78.15 -44.69 25.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.185 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 137' ' ' LYS . . . -76.78 55.69 1.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.097 0.475 . . . . 0.0 109.934 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.379 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.431 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 45.8 m-85 -57.98 119.21 6.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.538 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.06 -46.75 33.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.735 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.949 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER -51.18 -51.25 55.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.891 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.477 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.74 -41.34 98.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 110.188 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -55.9 -35.28 66.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.75 178.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.05 -44.65 25.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.171 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.83 -53.28 50.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.363 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -69.91 -27.17 64.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.086 179.033 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.522 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.22 -51.95 64.19 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.016 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.64 -27.0 60.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.539 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -53.92 -47.1 67.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.203 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.769 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.9 t-160 -78.81 -34.04 45.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.001 0.429 . . . . 0.0 110.611 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -62.31 -52.3 64.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.247 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -60.66 -52.61 64.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.133 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 93.1 mt -55.85 -31.88 63.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.483 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.66 -14.63 60.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.615 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.528 0.104 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.515 -179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.108 0.48 . . . . 0.0 111.704 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.912 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -105.53 134.24 48.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.367 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.724 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.4 ttm-85 -80.31 118.24 21.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.724 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -134.65 166.88 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.659 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.561 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.7 m -157.04 123.78 5.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.053 0.454 . . . . 0.0 111.103 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.563 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.05 176.44 17.08 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.857 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -131.01 117.72 19.58 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.879 HD11 ' HB1' ' A' ' 139' ' ' ALA . 70.2 mt -82.92 90.88 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.748 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -80.9 145.44 8.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.265 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.728 ' HB2' HG23 ' A' ' 29' ' ' ILE . 50.1 p90 -154.32 122.65 6.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.826 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -75.28 115.67 15.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.948 0.404 . . . . 0.0 110.729 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.236 179.903 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.67 0.272 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.728 HG23 ' HB2' ' A' ' 16' ' ' PHE . 9.1 mt -108.26 138.36 35.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.046 0.451 . . . . 0.0 111.873 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.64 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 60.0 mt-10 -134.19 119.44 18.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.973 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.639 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.9 m-85 -82.66 149.19 27.51 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 15' ' ' ILE . 38.9 tp -88.45 135.49 33.45 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.719 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.51 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.3 mt -135.82 141.54 44.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.808 0.337 . . . . 0.0 110.701 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.687 HD22 HD22 ' A' ' 112' ' ' LEU . 19.4 mt -119.64 112.77 19.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.97 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.464 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.5 tt0 -74.35 138.49 43.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.197 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.139 179.173 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.897 0.379 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.666 ' CE2' HD22 ' A' ' 130' ' ' LEU . 24.9 m95 -106.03 119.48 39.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.533 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -143.49 141.79 19.77 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.133 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.63 158.44 8.11 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.719 2.28 . . . . 0.0 112.405 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.505 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 44.1 Cg_endo -66.62 101.28 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.723 2.282 . . . . 0.0 112.199 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.553 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.14 153.04 19.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.054 0.454 . . . . 0.0 111.561 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.496 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.13 164.19 22.23 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.273 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.474 ' CE1' ' HB3' ' A' ' 8' ' ' LEU . 1.1 t-80 -96.54 102.85 14.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.645 0.26 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.724 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -71.26 130.72 35.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.08 0.466 . . . . 0.0 111.149 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -89.92 174.69 4.48 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.748 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.533 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 51.3 Cg_exo -56.0 -60.52 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.292 1.995 . . . . 0.0 112.462 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.92 7.28 63.35 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.928 -0.653 . . . . 0.0 113.471 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 41.6 tt0 -88.9 164.88 14.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 110.809 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.856 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -88.39 159.81 17.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.152 0.501 . . . . 0.0 110.631 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.419 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.66 -62.77 1.29 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.87 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.742 HD21 HG21 ' A' ' 77' ' ' ILE . 29.7 tp -64.43 -40.8 96.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.481 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.856 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.03 -46.4 52.92 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 120.589 0.233 . . . . 0.0 110.393 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 44.6 m -55.89 -46.73 78.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -66.79 -27.92 67.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.465 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.3 mt -77.06 -52.13 9.86 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.686 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.62 -36.37 80.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.051 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -67.36 -33.76 75.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.202 0.525 . . . . 0.0 109.649 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.748 HG23 HD11 ' A' ' 15' ' ' ILE . 98.6 m -61.22 -55.79 28.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.588 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -68.21 -20.67 64.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.883 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -79.21 -45.58 19.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.908 0.385 . . . . 0.0 110.876 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 3.2 mp0 -104.96 9.87 34.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.628 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -149.75 -9.36 0.3 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.441 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 69.93 0.94 29.76 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.01 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.634 HD13 HG11 ' A' ' 103' ' ' VAL . 1.3 mt -106.3 130.81 57.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 117.087 0.444 . . . . 0.0 110.913 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -113.24 172.85 6.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.95 -30.01 32.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.869 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.99 -10.84 78.35 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.162 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 8.4 mm100 -112.74 -14.46 13.11 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.1 -178.69 3.93 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.281 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.564 ' H ' ' H ' ' A' ' 102' ' ' GLU . 9.6 m -124.31 101.71 7.32 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.581 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.742 HG21 HD21 ' A' ' 57' ' ' LEU . 11.7 mm -78.0 123.59 35.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.69 179.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.553 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -87.97 136.88 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 0.0 111.372 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -94.54 151.29 19.46 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.939 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.34 -26.7 22.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.9 t80 -98.83 132.62 44.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.542 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -158.26 133.59 8.73 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.187 0.517 . . . . 0.0 111.388 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -160.21 143.13 13.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.739 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.872 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -129.65 128.53 42.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.932 0.396 . . . . 0.0 111.118 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.4 mt -89.99 118.25 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.222 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.502 HD22 ' HA ' ' A' ' 95' ' ' THR . 2.2 m120 -111.07 124.46 52.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.502 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.409 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 16.6 p90 -167.7 141.34 3.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.257 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.589 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.3 p -83.89 111.22 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.369 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.01 -102.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.796 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -64.07 -35.65 81.43 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.77 0.319 . . . . 0.0 111.01 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 2.6 p-10 173.19 30.72 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.856 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.847 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.92 126.09 2.63 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.78 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.912 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.3 Cg_endo -72.43 119.28 6.03 Favored 'Trans proline' 0 CA--C 1.512 -0.601 0 C-N-CA 123.136 2.557 . . . . 0.0 112.455 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.538 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -100.49 130.2 46.54 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.528 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.502 ' HA ' HD22 ' A' ' 86' ' ' ASN . 96.1 m -97.03 101.53 13.12 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.72 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 40.2 t -103.33 108.33 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.784 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.872 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.66 122.74 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.665 ' HB3' HG13 ' A' ' 14' ' ' ILE . 25.3 m-85 -110.66 128.18 55.59 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.184 0.516 . . . . 0.0 112.001 -178.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.618 ' CD2' HD13 ' A' ' 57' ' ' LEU . 10.9 m-90 -108.06 169.31 8.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.766 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.608 HD13 ' HG ' ' A' ' 147' ' ' LEU . 2.2 mt -101.52 109.06 20.8 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.621 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -118.75 151.73 37.48 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.093 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.564 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tm-20 -131.3 115.16 15.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.12 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.636 HG12 HD23 ' A' ' 75' ' ' LEU . 6.0 m -71.97 131.44 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.291 0.567 . . . . 0.0 110.632 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 74' ' ' GLN . 4.7 mttt -67.81 -26.04 65.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.178 -178.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.755 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 58.4 t0 -104.16 125.14 50.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.951 0.405 . . . . 0.0 112.047 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -62.24 -42.84 99.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.892 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.9 23.2 9.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.743 178.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.5 p -43.49 148.08 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.326 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.604 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -62.95 140.98 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.31 0.576 . . . . 0.0 111.745 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 33.0 mm -124.23 96.75 4.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.692 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -99.42 101.43 12.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.855 -178.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.719 HD11 ' HD1' ' A' ' 119' ' ' TYR . 9.2 mt -97.09 125.04 41.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.297 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.6 p -65.25 -164.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.422 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -80.29 13.96 2.16 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.676 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -104.54 -35.4 7.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.015 0.436 . . . . 0.0 110.68 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.528 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 42.0 m80 -107.25 123.32 48.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.608 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -92.5 -13.41 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.586 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -164.23 167.67 19.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.107 0.48 . . . . 0.0 111.761 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.8 p90 -146.63 168.54 21.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.512 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.433 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 18.8 mtt180 -156.08 156.55 34.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.136 0.493 . . . . 0.0 111.553 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.506 ' CE2' HD13 ' A' ' 32' ' ' LEU . 89.1 m95 -119.66 107.52 13.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.592 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.17 167.73 21.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.856 0.36 . . . . 0.0 111.601 -178.451 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -162.2 11.17 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.702 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 8.3 tp -67.92 -45.58 73.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.809 0.305 . . . . 0.0 111.048 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.4 pt-20 -55.14 -53.39 56.49 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.556 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.721 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -68.81 -51.89 35.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.018 0.437 . . . . 0.0 109.84 179.659 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.25 -27.46 9.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.489 . . . . 0.0 109.782 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 124' ' ' LEU . 0.2 OUTLIER -83.0 -33.25 26.59 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.742 178.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.636 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -64.7 -45.83 84.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.788 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.666 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -77.4 -36.98 52.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.199 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.82 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.67 49.66 1.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.648 179.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.77 -30.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.066 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -65.0 127.19 30.59 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.58 -56.59 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.001 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.971 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.77 -50.17 26.43 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.089 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.82 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.36 -36.51 75.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.497 -179.433 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -62.13 -32.61 73.22 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.773 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.09 -46.3 35.54 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.699 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.65 -44.66 66.28 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.052 0.454 . . . . 0.0 110.527 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.72 -24.83 41.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.435 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.563 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.06 -52.11 46.21 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.523 -179.469 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -72.66 -30.85 64.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.44 -47.27 84.59 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.742 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.523 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -75.0 -35.11 62.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.085 0.469 . . . . 0.0 110.17 179.296 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -65.09 -52.94 52.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.686 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -63.89 -53.78 45.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 111.159 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.637 HD13 ' CZ ' ' A' ' 16' ' ' PHE . 94.9 mt -55.86 -28.54 57.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.737 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 41.2 t -73.72 -8.37 55.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.522 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.62 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.899 0.381 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -111.88 133.99 53.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.178 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.687 ' HB3' HG13 ' A' ' 50' ' ' VAL . 3.6 ttt-85 -79.53 119.85 23.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.476 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.471 ' HB2' ' CG ' ' A' ' 94' ' ' LYS . . . -132.49 163.46 28.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.109 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 46.1 m -156.24 123.85 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.056 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.64 174.06 15.07 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.75 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.725 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -124.95 118.15 25.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.126 0.463 . . . . 0.0 111.872 -179.229 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.909 HD11 ' HB1' ' A' ' 139' ' ' ALA . 52.3 mt -82.44 91.68 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.952 HD11 HG23 ' A' ' 64' ' ' THR . 25.8 mt -83.75 146.46 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.1 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.657 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.45 122.68 7.16 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.657 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.546 ' CZ ' ' HG3' ' A' ' 30' ' ' GLU . 1.2 ppt_? -83.29 112.86 20.27 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.014 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.471 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 5.3 ttp180 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.401 -179.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 121.0 0.429 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.657 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -116.09 137.28 50.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.178 0.513 . . . . 0.0 111.866 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.606 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -136.12 126.81 27.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.468 179.196 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.5 m-85 -86.75 147.41 25.86 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.5 tp -84.04 133.08 34.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.676 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.7 mt -134.32 137.25 44.07 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.951 0.405 . . . . 0.0 110.815 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' HG3' ' A' ' 46' ' ' PRO . 2.2 mt -120.73 105.09 10.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.634 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 1.7 tt0 -59.49 132.77 55.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.212 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 42' ' ' HIS . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.42 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.475 ' CE1' ' HB2' ' A' ' 36' ' ' ALA . 6.9 p80 . . . . . 0 CA--C 1.521 -0.153 0 CA-C-O 120.785 0.326 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 81.0 m95 -120.2 101.99 8.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.638 179.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.454 HG23 ' ND1' ' A' ' 42' ' ' HIS . 71.5 p -126.37 154.32 74.85 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.563 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.548 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 63.4 Cg_endo -70.27 173.88 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.408 2.072 . . . . 0.0 111.969 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.704 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.9 Cg_exo -63.93 86.93 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.517 2.145 . . . . 0.0 112.082 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.58 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 1.2 pttt -96.21 152.26 18.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 111.054 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.14 -177.87 15.88 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.889 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.469 ' CD2' ' HD2' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -107.0 115.92 31.02 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 110.504 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.687 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -90.42 128.84 42.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 121.241 0.543 . . . . 0.0 111.179 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 3.0 tt0 -92.06 153.51 43.3 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.799 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 5.2 Cg_endo -47.7 -43.21 29.06 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.968 2.445 . . . . 0.0 112.432 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.425 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -80.43 -15.21 78.77 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -83.53 164.42 19.82 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.798 0.332 . . . . 0.0 111.258 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.865 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 12.0 t70 -85.22 161.44 19.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.473 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.549 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 1.7 m-20 -72.64 -64.76 0.89 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.606 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.708 HD21 HG21 ' A' ' 77' ' ' ILE . 28.4 tp -63.43 -41.6 98.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.865 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.1 OUTLIER -49.86 -46.3 51.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.512 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.1 m -55.8 -44.87 78.22 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -68.5 -30.06 68.81 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.927 178.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.7 mt -73.14 -52.42 14.25 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.26 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.1 84.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.327 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.58 -34.04 76.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.261 0.553 . . . . 0.0 109.806 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.952 HG23 HD11 ' A' ' 15' ' ' ILE . 39.6 m -59.12 -52.62 64.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.588 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.8 pt20 -74.59 -23.13 58.7 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.2 -35.45 48.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.899 0.38 . . . . 0.0 110.812 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.494 ' HB3' HD13 ' A' ' 34' ' ' LEU . 5.5 mt-10 -109.8 3.05 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.868 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -150.73 -6.97 0.28 Allowed 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.63 2.38 43.47 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 120.071 -1.061 . . . . 0.0 112.618 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.749 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -105.85 128.16 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-O 120.878 0.371 . . . . 0.0 110.301 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 4.4 pm0 -112.19 172.23 7.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.482 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.823 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.67 -31.97 39.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.999 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.79 -6.42 81.76 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.175 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.63 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -112.88 -14.36 13.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.548 0.213 . . . . 0.0 110.968 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.86 -171.07 2.21 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.6 m -130.91 98.78 4.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.251 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.708 HG21 HD21 ' A' ' 57' ' ' LEU . 12.3 mm -73.22 122.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.037 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.693 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -85.28 135.58 24.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -92.97 151.43 19.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.267 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.71 -23.18 37.09 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.524 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.702 ' CD1' HD21 ' A' ' 100' ' ' LEU . 19.8 t80 -102.13 126.11 49.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.841 0.353 . . . . 0.0 110.917 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.468 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.2 ttpt -158.1 125.18 4.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.191 0.52 . . . . 0.0 111.306 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.9 137.54 23.76 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.612 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.827 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.08 127.5 51.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.991 0.424 . . . . 0.0 111.496 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.976 HD13 ' HB2' ' A' ' 135' ' ' GLU . 6.7 mt -92.73 117.34 29.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.225 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.629 HD21 HG23 ' A' ' 95' ' ' THR . 2.0 m-80 -107.02 123.76 48.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.3 -178.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 25.5 p90 -166.88 143.48 4.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.16 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.592 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.0 p -84.31 111.42 20.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.541 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.4 -106.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.241 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -41.55 88.47 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.927 0.394 . . . . 0.0 110.763 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 177.9 29.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.732 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.791 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -155.48 125.84 3.38 Favored Pre-proline 0 N--CA 1.452 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.562 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.53 119.99 6.77 Favored 'Trans proline' 0 CA--C 1.513 -0.544 0 C-N-CA 123.179 2.586 . . . . 0.0 112.481 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.471 ' CG ' ' HB2' ' A' ' 10' ' ' ALA . 6.0 ttpt -106.89 119.02 38.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.96 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.629 HG23 HD21 ' A' ' 86' ' ' ASN . 47.7 m -82.19 107.74 15.12 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.735 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 46.3 t -104.28 107.97 23.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.914 -178.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.827 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.47 131.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.657 ' HB3' HG13 ' A' ' 14' ' ' ILE . 6.1 m-85 -116.24 136.74 52.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.287 0.565 . . . . 0.0 112.135 -177.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.549 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 8.9 m-90 -125.01 140.91 52.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.238 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -74.76 132.21 41.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.709 -0.396 . . . . 0.0 109.936 179.171 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -141.15 135.75 31.16 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.821 0.343 . . . . 0.0 111.549 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.8 tm-20 -113.55 115.8 28.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.257 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.763 HG12 HD23 ' A' ' 75' ' ' LEU . 16.3 m -71.89 122.25 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-O 121.159 0.504 . . . . 0.0 110.447 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -64.05 -22.34 66.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.661 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.912 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -100.91 111.46 23.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.27 0.557 . . . . 0.0 111.711 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -56.69 -39.14 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.65 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -105.76 28.07 7.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.551 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.912 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.3 p -48.18 149.08 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.699 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.438 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 2.1 pm0 -72.24 144.0 48.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 110.577 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.774 HG21 ' CG ' ' A' ' 119' ' ' TYR . 37.6 mm -121.66 94.59 3.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.659 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.473 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.3 OUTLIER -97.59 98.61 10.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.715 -179.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.686 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.0 mt -83.09 174.64 10.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HG2' ' A' ' 115' ' ' GLU . 24.7 p -116.18 -167.72 1.32 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -59.94 -43.48 94.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.997 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.401 ' HG2' ' OG ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -69.37 -4.52 18.68 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.495 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 40.1 m-70 -120.99 144.45 48.5 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 111.314 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -127.53 -18.12 4.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.628 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.72 154.89 18.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.939 0.399 . . . . 0.0 111.421 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.774 ' CG ' HG21 ' A' ' 110' ' ' ILE . 37.8 p90 -136.65 168.15 20.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.41 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 119' ' ' TYR . 6.7 mtt180 -156.19 159.85 39.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.134 0.492 . . . . 0.0 111.598 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.3 m95 -121.33 109.28 14.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.644 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.32 168.33 19.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.028 0.442 . . . . 0.0 111.623 -178.712 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.56 -153.34 3.28 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.714 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.506 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.1 tp -77.13 -43.15 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.808 0.337 . . . . 0.0 111.063 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -59.19 -48.9 79.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.837 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.67 -41.0 63.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.933 0.397 . . . . 0.0 110.851 -179.376 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.58 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -61.22 -29.56 69.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.263 0.554 . . . . 0.0 109.515 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.3 -33.5 23.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.502 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.823 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.71 -42.73 95.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.636 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.621 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -77.35 -43.12 34.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.71 57.71 2.58 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.73 178.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.5 -36.94 0.18 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.929 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.531 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 6.9 m-85 -54.62 118.98 4.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.766 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.09 -51.95 12.95 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.106 0.479 . . . . 0.0 110.605 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.976 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -50.95 -53.35 33.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.564 179.917 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.761 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.74 -37.17 78.24 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -61.25 -34.95 76.0 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.65 -46.17 55.33 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.895 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.909 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.74 -45.71 63.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.099 0.475 . . . . 0.0 110.004 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.58 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -76.39 -29.69 57.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 178.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.567 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.22 -52.45 47.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.171 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -69.35 -30.63 68.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.252 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.441 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.16 -44.67 88.74 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.657 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 3.5 t-80 -78.19 -34.23 49.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.748 0.309 . . . . 0.0 110.351 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -61.82 -52.77 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.482 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.64 -50.43 69.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.105 0.479 . . . . 0.0 110.694 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.539 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.4 mt -57.21 -34.65 68.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.791 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -73.5 -17.48 61.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.697 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.718 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.745 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.636 0.731 . . . . 0.94 109.907 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.059 HD13 ' HG2' ' A' ' 94' ' ' LYS . 1.0 OUTLIER -72.26 125.73 28.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.655 -1.157 . . . . 0.96 111.618 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.476 ' HB3' HG13 ' A' ' 50' ' ' VAL . 4.9 ttt180 -78.47 111.53 14.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 2.62 110.057 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -129.02 168.38 16.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.776 -0.647 . . . . 0.72 110.796 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.457 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.1 m -157.11 122.41 4.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.68 110.905 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.99 171.98 14.09 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.557 -0.747 . . . . 0.45 111.421 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.476 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -126.61 117.11 22.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.987 0.394 . . . . 0.36 111.103 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.903 HD11 ' HB1' ' A' ' 139' ' ' ALA . 84.3 mt -82.79 91.2 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.091 -1.077 . . . . 0.56 108.091 177.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.868 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -78.44 145.39 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 114.913 -1.04 . . . . 0.3 111.087 -178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.5 p90 -149.12 121.38 8.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 123.431 0.457 . . . . 1.26 111.49 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.94 111.64 17.59 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.791 -0.448 . . . . 4.32 109.791 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.234 0.241 0 CA-C-N 116.107 -0.497 . . . . 2.64 111.247 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.649 0.261 . . . . 0.73 110.971 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.702 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.8 mt -121.4 135.31 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.51 111.389 -179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.3 120.93 28.07 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.087 -0.506 . . . . 1.91 110.248 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 47.1 m-85 -82.1 149.62 27.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 1.27 112.209 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.633 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 52.4 tp -87.18 134.07 33.57 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.743 -0.662 . . . . 0.27 110.032 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.557 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.2 mt -133.69 134.64 43.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.34 -0.391 . . . . 0.34 111.085 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 46' ' ' PRO . 20.7 mt -113.0 113.43 25.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.074 -0.512 . . . . 0.45 110.803 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -69.62 144.35 53.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.892 -0.594 . . . . 1.69 111.606 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.236 0 CA-C-N 115.972 -0.558 . . . . 1.16 110.362 179.086 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.775 0.321 . . . . 1.2 110.834 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.557 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 56.8 m95 -95.03 122.59 37.85 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.079 -0.509 . . . . 0.65 110.852 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -145.17 144.68 24.25 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.003 -0.544 . . . . 0.66 110.9 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.48 171.61 3.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.775 2.316 . . . . 0.75 112.221 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.627 ' HG3' HD11 ' A' ' 34' ' ' LEU . 19.8 Cg_exo -65.04 101.86 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.626 2.217 . . . . 0.61 112.264 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.14 142.87 30.07 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.207 -0.452 . . . . 1.85 110.97 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -128.55 176.71 18.13 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.104 -0.57 . . . . 0.77 112.56 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.1 103.89 12.68 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.726 0.298 . . . . 2.71 110.63 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.602 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -79.31 121.43 32.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 121.113 0.483 . . . . 0.93 111.106 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.41 158.38 54.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.5 -0.773 . . . . 1.98 109.978 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.73 -53.59 6.34 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.927 2.418 . . . . 1.4 112.453 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.84 -13.24 83.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 121.014 -0.612 . . . . 1.18 113.189 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -81.87 155.33 25.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.884 0.342 . . . . 1.43 111.114 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 34.9 t70 -79.27 158.3 27.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.244 -0.434 . . . . 1.33 110.702 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.465 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -69.3 -62.32 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.852 -0.613 . . . . 1.74 111.598 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.736 HD21 HG21 ' A' ' 77' ' ' ILE . 9.1 tp -62.51 -40.23 96.06 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.789 -0.187 . . . . 0.61 111.485 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.84 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -51.6 -40.76 60.43 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.972 0.17 . . . . 1.91 110.692 179.657 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.602 HG21 ' N ' ' A' ' 50' ' ' VAL . 96.3 m -61.9 -46.96 87.09 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 110.057 -0.349 . . . . 0.63 110.057 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.24 -43.23 99.31 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 109.63 -0.507 . . . . 0.48 109.63 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.85 HD22 ' HB2' ' A' ' 72' ' ' ALA . 97.9 mt -60.39 -52.77 63.81 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.371 -0.831 . . . . 0.5 110.901 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -42.62 85.86 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.868 -0.606 . . . . 2.79 110.809 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.44 -35.64 79.89 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.29 -0.413 . . . . 0.44 111.098 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.868 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -63.99 -43.28 96.17 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.192 -0.458 . . . . 0.34 111.208 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.584 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 3.9 pt20 -80.08 -24.64 40.48 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.536 0.199 . . . . 1.71 111.536 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -79.93 -46.05 17.43 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.695 -0.23 . . . . 1.77 111.465 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 21.9 mt-10 -97.81 -11.45 23.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.679 0.622 . . . . 2.0 112.679 -179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -131.96 -3.46 3.6 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.83 0.678 . . . . 0.37 112.83 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 69.65 6.34 54.77 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.391 -0.909 . . . . 0.37 113.546 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.606 ' O ' HG22 ' A' ' 64' ' ' THR . 2.4 mt -111.09 120.12 61.07 Favored 'Isoleucine or valine' 0 C--N 1.341 0.23 0 CA-C-N 117.378 0.589 . . . . 0.34 111.346 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.6 pt-20 -97.0 172.27 7.96 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 1.82 110.642 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -50.68 -42.01 56.36 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.998 0.37 . . . . 0.45 111.998 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.78 -25.7 71.87 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 120.998 -0.62 . . . . 0.48 112.742 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.534 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 5.9 tp60 -86.87 2.86 47.72 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 111.773 0.286 . . . . 1.54 111.773 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.841 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -139.48 -164.34 1.66 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.663 0.268 . . . . 0.44 110.5 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.436 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.4 m -143.02 100.85 3.72 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.331 -0.395 . . . . 0.51 110.168 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.736 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -75.11 118.06 20.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.99 -0.55 . . . . 0.55 111.414 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.596 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -78.7 136.93 22.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.712 -0.677 . . . . 0.57 110.682 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.99 146.96 23.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.423 -0.808 . . . . 1.5 111.129 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.98 -28.36 15.61 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.822 -0.704 . . . . 0.75 113.063 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD21 ' A' ' 100' ' ' LEU . 37.9 t80 -98.88 128.91 45.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.34 111.633 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -158.25 126.87 5.48 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.707 -0.679 . . . . 1.41 110.655 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -152.01 129.57 11.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.586 . . . . 3.01 110.75 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.739 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -110.74 137.49 48.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.886 0.374 . . . . 1.42 111.248 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.973 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.8 mt -102.2 121.61 42.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.781 -0.645 . . . . 0.69 110.553 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.478 HD21 HG23 ' A' ' 95' ' ' THR . 4.7 m-80 -110.27 127.26 54.91 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.301 -0.409 . . . . 1.75 111.773 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.417 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 14.5 p90 -167.3 141.6 3.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.788 -0.642 . . . . 1.48 111.428 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.55 ' O ' HG13 ' A' ' 88' ' ' VAL . 9.9 p -82.77 112.6 20.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.49 -0.559 . . . . 0.91 109.49 177.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.76 -91.56 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.34 -0.391 . . . . 0.9 111.38 -178.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -82.69 -44.76 15.3 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.877 0.37 . . . . 3.5 110.09 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -169.95 31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.869 -0.605 . . . . 2.28 111.0 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.989 ' HB3' HD11 ' A' ' 8' ' ' LEU . 8.7 tptt -161.16 126.19 2.17 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.981 0.42 . . . . 2.21 110.904 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.876 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.6 Cg_endo -66.41 121.34 8.59 Favored 'Trans proline' 0 N--CA 1.476 0.457 0 C-N-CA 123.745 2.963 . . . . 0.91 112.715 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 1.059 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -101.69 121.33 41.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.002 -0.545 . . . . 1.58 111.713 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.478 HG23 HD21 ' A' ' 86' ' ' ASN . 90.1 m -92.76 106.25 18.25 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.93 -0.767 . . . . 0.83 108.93 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.0 t -107.01 106.46 20.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 111.735 0.272 . . . . 0.67 111.735 -178.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.739 HD13 ' HB3' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -87.0 124.63 40.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.259 -0.645 . . . . 0.75 109.259 178.517 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.512 ' HB3' HG13 ' A' ' 14' ' ' ILE . 45.5 m-85 -109.01 158.04 18.1 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.876 0.695 . . . . 1.28 112.876 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.474 ' CD2' HD13 ' A' ' 57' ' ' LEU . 15.2 m-90 -141.39 157.98 44.47 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 114.762 -1.108 . . . . 0.72 109.82 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.596 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 2.0 mt -92.63 108.29 19.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.679 0.276 . . . . 0.54 110.261 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.535 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -117.97 125.29 50.11 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.432 -0.349 . . . . 0.35 110.645 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CZ ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -104.93 113.89 27.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 1.38 111.093 -179.377 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.841 HG12 HD23 ' A' ' 75' ' ' LEU . 10.2 m -72.61 125.63 31.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 121.127 0.489 . . . . 0.53 110.404 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.503 ' HE2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -70.37 -16.49 62.98 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.667 -0.697 . . . . 1.44 112.646 -178.338 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.753 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 1.1 t70 -105.05 129.85 53.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.757 0.313 . . . . 2.39 111.042 179.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.4 -41.04 73.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 2.98 109.932 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.83 32.07 3.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.785 -0.643 . . . . 2.29 110.325 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.6 p -52.14 140.61 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 115.93 -0.577 . . . . 0.59 110.33 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -62.0 140.65 58.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.259 0.552 . . . . 1.26 111.693 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.782 HG21 ' CG ' ' A' ' 119' ' ' TYR . 41.4 mm -120.39 98.84 6.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.245 -0.889 . . . . 0.46 110.012 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 5.4 mtt180 -101.01 98.48 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.532 -0.758 . . . . 3.2 110.844 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.705 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.4 mt -87.67 146.0 25.9 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.589 -0.732 . . . . 0.75 111.73 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.2 m -91.07 -172.35 3.29 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.709 -0.678 . . . . 1.55 110.718 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -60.28 -28.77 68.35 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.718 -0.219 . . . . 2.76 111.531 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.75 -44.52 73.58 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 111.798 0.295 . . . . 2.63 111.798 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -104.34 123.75 47.96 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 1.32 111.498 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -95.42 -26.34 15.9 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.076 -0.511 . . . . 2.68 111.814 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -141.61 168.12 20.52 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.03 0.443 . . . . 0.64 111.654 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.782 ' CG ' HG21 ' A' ' 110' ' ' ILE . 31.5 p90 -148.24 161.78 40.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.71 -0.677 . . . . 1.33 110.635 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -153.78 153.97 33.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.139 0.495 . . . . 2.05 111.655 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.561 ' CE2' HD13 ' A' ' 32' ' ' LEU . 82.9 m95 -117.28 106.94 13.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.256 -0.884 . . . . 0.46 109.049 178.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.42 168.77 18.59 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.938 0.399 . . . . 0.45 111.829 -178.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.48 -158.13 6.95 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.835 -0.621 . . . . 0.43 112.209 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.4 tp -72.71 -45.79 56.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.596 0.198 . . . . 0.5 111.17 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.6 pt-20 -58.36 -48.65 79.9 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.128 0.418 . . . . 1.34 112.128 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.03 -42.09 60.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.689 -0.232 . . . . 1.28 111.041 -179.465 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.557 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.99 -31.01 69.51 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.844 -0.428 . . . . 0.37 109.844 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.65 -37.56 35.7 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.62 -0.718 . . . . 1.46 110.263 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -59.47 -42.67 92.57 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.402 -0.363 . . . . 1.29 111.042 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.598 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -78.22 -42.51 31.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.348 -0.387 . . . . 0.51 110.849 179.174 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.793 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.04 56.41 1.98 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.202 0.525 . . . . 0.5 109.858 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.31 -39.48 0.28 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.824 -1.08 . . . . 2.53 111.951 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.443 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 56.5 m-85 -56.08 120.39 7.41 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.18 -0.464 . . . . 1.51 109.877 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -57.21 4.35 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.931 0.715 . . . . 1.86 112.931 -177.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.973 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.58 -47.2 28.61 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.177 0.298 . . . . 1.71 111.391 -179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.793 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.07 -46.75 87.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.196 -0.298 . . . . 0.62 110.196 179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -40.92 72.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.893 -0.594 . . . . 1.41 110.078 178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.523 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.8 -41.88 74.47 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-N 115.97 -0.559 . . . . 0.57 111.143 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.903 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.51 -46.89 80.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.95 0.405 . . . . 0.49 109.967 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.5 mt -71.76 -31.16 66.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.625 -0.716 . . . . 0.41 110.042 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.89 -51.75 56.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.918 -0.583 . . . . 1.19 111.187 179.579 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.56 -31.7 71.11 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.097 -0.501 . . . . 2.28 110.928 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -60.2 -46.09 94.87 Favored Glycine 0 C--N 1.338 0.662 0 C-N-CA 120.786 -0.721 . . . . 0.49 111.655 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -72.12 -36.09 69.31 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.551 0.215 . . . . 1.38 110.537 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -64.7 -52.71 55.72 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.276 -0.42 . . . . 1.47 111.441 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -56.66 -51.38 68.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.084 -0.507 . . . . 1.36 111.065 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.544 ' CD2' HG12 ' A' ' 78' ' ' ILE . 87.5 mt -59.13 -37.26 76.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.112 -0.494 . . . . 0.64 111.671 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 2.0 t -70.45 -19.33 62.97 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.615 0.245 . . . . 1.04 110.72 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-N 116.372 -0.376 . . . . 1.01 111.503 179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.984 0.421 . . . . 0.0 110.707 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.906 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.47 126.17 54.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.517 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.812 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.8 OUTLIER -78.19 123.82 27.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 48' ' ' GLY . . . -142.83 160.03 41.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.122 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.476 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 80.0 m -150.72 123.79 8.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.176 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.578 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -111.74 177.25 18.74 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.446 ' HA ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -130.26 118.18 20.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.589 0.695 . . . . 0.0 112.328 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.724 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.8 mt -82.64 91.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 27.5 mt -81.51 145.9 8.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.339 -178.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.649 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 35.5 p90 -152.94 127.27 9.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.372 -178.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.503 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.08 113.02 23.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.006 0.431 . . . . 0.0 110.119 178.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.466 -179.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.906 0.384 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.581 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.8 mt -102.39 149.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.705 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.649 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.8 mp0 -116.7 172.65 7.09 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.036 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 27.9 m-85 -135.14 129.11 33.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.564 0.221 . . . . 0.0 111.14 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -71.95 133.08 45.15 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.593 HD22 ' HB3' ' A' ' 43' ' ' TRP . 4.0 mt -133.99 144.74 48.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.729 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 112' ' ' LEU . 51.7 mt -123.41 109.73 14.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.065 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.488 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 5.1 tt0 -72.62 143.38 48.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.423 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.636 179.254 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 . . . . . 0 CA--C 1.522 -0.133 0 CA-C-O 120.783 0.325 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.682 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.8 m95 -103.91 140.93 37.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.305 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.691 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -163.43 141.8 6.22 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.901 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.5 Cg_endo -66.42 169.11 14.68 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.367 2.044 . . . . 0.0 111.896 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.607 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 51.7 Cg_exo -51.69 103.98 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.594 2.196 . . . . 0.0 112.644 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.61 124.05 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.967 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.26 169.68 13.39 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.322 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -118.25 104.84 11.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.702 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.812 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.56 129.29 37.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.425 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.655 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -91.48 177.36 2.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.408 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.655 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.5 Cg_exo -57.34 -54.2 3.81 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.402 2.068 . . . . 0.0 112.87 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.23 3.73 86.56 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.373 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 21.6 tt0 -84.43 171.24 12.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.901 0.35 . . . . 0.0 110.736 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.884 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.7 t70 -97.06 157.73 15.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.273 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.543 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 12.9 m-20 -70.04 -64.92 0.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.281 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 22.7 tp -62.79 -42.93 99.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.113 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.884 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -49.35 -43.08 43.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.543 -179.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 25.9 m -58.56 -45.26 89.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.04 -30.04 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.823 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.756 HD22 ' HB2' ' A' ' 72' ' ' ALA . 88.4 mt -72.93 -51.85 16.91 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.118 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -41.71 95.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.802 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.502 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -61.39 -39.57 91.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.173 0.511 . . . . 0.0 109.826 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -58.18 -47.03 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.891 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.476 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 13.2 pt20 -80.0 -25.15 40.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.978 0.418 . . . . 0.0 110.484 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -30.06 50.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.718 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 69.2 mm-40 -107.68 -27.07 10.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.772 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -121.8 -7.93 8.98 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.895 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 79.49 -8.87 45.33 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 119.712 -1.232 . . . . 0.0 112.77 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.675 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.6 mt -93.82 132.71 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 120.866 0.365 . . . . 0.0 110.468 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pt-20 -116.52 170.18 8.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.21 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.5 -39.53 10.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.47 -21.66 68.89 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.435 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.444 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 7.1 tp60 -100.66 -3.39 30.42 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.03 -170.9 2.55 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 178.211 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.573 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 57.4 m -136.36 98.18 3.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 111.617 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.575 HG21 ' CD2' ' A' ' 57' ' ' LEU . 5.7 mm -69.28 127.89 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.137 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -92.43 137.76 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -97.98 151.3 20.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.126 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.11 -31.22 8.9 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.975 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.789 ' CE1' HD21 ' A' ' 100' ' ' LEU . 10.3 t80 -103.64 105.17 15.32 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 120.894 0.378 . . . . 0.0 110.72 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -135.68 122.35 20.94 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.339 0.59 . . . . 0.0 110.639 179.589 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -140.9 148.33 40.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.917 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.866 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.8 pm0 -133.06 125.36 29.45 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.431 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.902 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.2 mt -91.95 116.68 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.046 179.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.81 129.92 56.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.829 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -166.75 141.76 4.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 92' ' ' LYS . 7.7 p -81.99 111.42 18.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.847 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.48 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.887 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -37.47 18.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.066 0.46 . . . . 0.0 110.932 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 177.64 26.44 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.534 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.785 ' HB3' HD11 ' A' ' 8' ' ' LEU . 2.7 tptt -155.11 120.85 2.62 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.848 ' O ' HD12 ' A' ' 8' ' ' LEU . 43.4 Cg_endo -68.73 117.84 5.27 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.372 2.715 . . . . 0.0 113.053 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.906 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -100.58 115.46 30.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.985 -179.356 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 48.0 m -86.28 120.75 27.97 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.715 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.2 t -116.67 108.12 24.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.014 -0.275 . . . . 0.0 111.692 -178.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.866 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -84.52 125.63 40.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.535 ' HB3' ' CD1' ' A' ' 14' ' ' ILE . 9.4 m-85 -113.15 130.75 56.1 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.144 -177.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.547 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.7 m-90 -114.9 156.86 24.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.698 178.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.789 HD21 ' CE1' ' A' ' 81' ' ' PHE . 2.1 mt -93.18 113.13 25.28 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.573 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -124.81 148.94 47.9 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.966 0.412 . . . . 0.0 111.788 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.603 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.2 OUTLIER -123.38 117.94 26.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.129 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.706 HG12 HD23 ' A' ' 75' ' ' LEU . 7.6 m -71.94 132.61 33.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.853 0.358 . . . . 0.0 110.367 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.85 -20.68 66.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.702 -178.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.724 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 60.3 t0 -111.89 120.57 42.38 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 8.1 t80 -58.98 -38.12 78.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.353 178.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -105.69 26.1 9.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.996 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.724 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.6 p -43.3 149.02 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.456 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.583 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -70.21 142.93 52.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.222 0.535 . . . . 0.0 111.298 -179.099 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.832 HG21 ' CG ' ' A' ' 119' ' ' TYR . 46.1 mm -120.15 99.67 7.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.758 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.895 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 3.9 mtp180 -98.77 100.4 11.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.913 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 34' ' ' LEU . 14.0 mt -90.3 153.7 20.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.77 -166.84 1.13 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.0 m80 -68.21 -1.45 6.16 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.37 -27.65 18.21 Favored 'General case' 0 C--N 1.335 -0.051 0 CA-C-O 120.838 0.351 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.543 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 23.5 m80 -127.15 141.38 51.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.689 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -100.58 -17.64 16.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.082 -179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.44 169.44 13.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.971 0.415 . . . . 0.0 111.515 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.832 ' CG ' HG21 ' A' ' 110' ' ' ILE . 35.9 p90 -140.42 174.96 10.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.112 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.56 163.07 33.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.313 0.578 . . . . 0.0 111.682 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.485 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 72.4 m95 -128.83 107.67 9.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.047 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -142.43 166.68 24.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.18 0.514 . . . . 0.0 111.819 -178.185 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.32 -151.34 1.72 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.313 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.543 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.1 tp -76.98 -47.19 21.47 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.923 0.392 . . . . 0.0 111.19 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -56.88 -51.79 67.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.787 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.96 -48.93 61.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.949 0.404 . . . . 0.0 110.787 -179.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.484 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -54.66 -29.24 52.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.323 0.582 . . . . 0.0 109.926 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.1 m -84.46 -32.58 23.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.407 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.822 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.64 -43.56 84.31 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.808 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.682 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.1 mt -77.42 -42.91 34.38 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.2 51.86 1.24 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.466 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.93 -29.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.707 -179.194 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.476 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 13.7 m-85 -60.47 119.84 8.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.327 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.48 -48.37 19.1 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.876 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.902 ' HB3' HD13 ' A' ' 85' ' ' LEU . 34.0 mp0 -48.16 -54.58 12.89 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.666 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.691 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -65.13 -42.17 94.13 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.33 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.61 -39.32 61.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.059 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.552 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.28 -46.75 60.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.771 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.4 -49.76 60.95 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.665 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.509 HD12 ' O ' ' A' ' 136' ' ' MET . 0.3 OUTLIER -72.94 -32.02 64.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.953 178.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.552 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -59.66 -52.29 66.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.248 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.432 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 3.0 mt-10 -71.55 -27.48 63.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.949 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.98 -42.73 92.97 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.894 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -76.27 -36.58 58.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.016 0.436 . . . . 0.0 110.22 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -63.48 -52.6 60.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.05 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -65.33 -51.95 57.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.463 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.449 ' HG ' HD13 ' A' ' 100' ' ' LEU . 75.5 mt -56.96 -25.16 57.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.886 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.4 t -78.39 -18.64 54.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.747 0.308 . . . . 0.0 110.611 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.697 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.205 0 CA-C-O 121.109 0.481 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.982 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.24 139.42 44.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.208 179.2 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.862 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtt180 -82.8 125.02 30.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.366 -179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.733 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -137.64 165.93 25.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.991 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -160.59 123.82 3.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.298 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.577 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.02 172.3 14.16 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.72 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.682 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.5 OUTLIER -125.46 117.92 24.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -179.432 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 1.002 HD11 ' HB1' ' A' ' 139' ' ' ALA . 43.2 mt -83.74 92.02 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -82.45 146.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.982 -178.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.741 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 53.7 p90 -152.24 121.41 6.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.278 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 2.5 ptm180 -82.16 114.69 20.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.224 0.535 . . . . 0.0 110.25 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.421 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 23.8 ttp85 . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.248 -179.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 -0.07 0 CA-C-O 120.819 0.342 . . . . 0.0 111.404 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.741 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.2 mt -107.64 143.87 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 111.905 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.626 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -132.79 126.84 33.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.104 179.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.3 m-85 -89.71 151.68 21.73 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.609 HD23 ' CD1' ' A' ' 15' ' ' ILE . 47.8 tp -86.72 133.99 33.63 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.0 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.577 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.3 mt -135.23 144.33 46.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 112' ' ' LEU . 14.4 mt -123.61 113.24 18.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.086 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.491 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.5 tt0 -74.1 140.48 45.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.209 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.505 179.19 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.2 p-80 . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.868 0.366 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.694 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 46.6 m95 -98.71 140.79 32.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.67 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.793 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -163.27 142.59 6.66 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 -179.718 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 175.95 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.383 2.055 . . . . 0.0 112.105 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.684 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 6.8 Cg_exo -73.3 102.4 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.851 2.367 . . . . 0.0 112.428 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.7 OUTLIER -110.36 157.59 19.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.393 179.435 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -148.84 173.01 28.89 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.5 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 26.1 t-80 -99.29 110.53 23.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.862 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.92 134.6 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.726 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 8.6 tt0 -90.63 150.99 43.45 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.239 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.5 -21.82 19.78 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.861 2.374 . . . . 0.0 113.033 -178.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.725 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.64 -9.75 42.71 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.337 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -89.64 171.49 9.64 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.607 0.241 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.926 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.9 t70 -87.84 160.98 17.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.046 0.45 . . . . 0.0 110.651 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.588 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 16.7 m-20 -71.52 -58.99 3.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.146 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 77' ' ' ILE . 23.0 tp -65.97 -42.13 90.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.211 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.926 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.82 -42.54 47.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.7 0.286 . . . . 0.0 110.503 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.541 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 98.5 m -60.48 -44.08 96.3 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.17 -30.35 67.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.879 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.847 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.8 mt -71.83 -51.98 19.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.354 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -60.61 -42.35 96.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.593 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 66' ' ' GLU . . . -59.52 -33.58 71.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.178 0.513 . . . . 0.0 109.779 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 66.5 m -59.14 -53.64 56.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.301 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.534 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.7 pt20 -72.6 -20.94 61.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.028 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 1.5 mm-40 -77.96 -40.25 39.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.841 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 59.1 mm-40 -111.34 12.8 21.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.346 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -154.54 -11.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.618 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.05 2.41 46.86 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.291 -0.957 . . . . 0.0 113.123 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.673 ' O ' HG22 ' A' ' 64' ' ' THR . 1.5 mt -105.47 129.65 58.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.815 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.8 pm0 -110.17 172.38 6.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.648 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.27 -36.26 20.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.15 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.68 -18.96 72.65 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.062 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.517 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 4.7 mt-30 -100.76 -5.02 26.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.546 0.213 . . . . 0.0 111.28 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.936 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -132.75 -170.15 2.39 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.417 177.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.561 ' H ' ' H ' ' A' ' 102' ' ' GLU . 55.2 m -133.54 100.37 4.78 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.049 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 57' ' ' LEU . 17.7 mm -74.39 123.38 29.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.242 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.592 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -83.32 139.06 18.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -97.88 144.98 26.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.173 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.2 -23.52 31.72 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.884 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.583 ' CE1' HD21 ' A' ' 100' ' ' LEU . 11.0 t80 -103.44 128.55 50.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.155 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.483 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -157.98 130.98 7.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.265 179.485 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -151.99 137.27 17.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.913 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.95 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -120.52 134.07 55.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.134 0.492 . . . . 0.0 112.04 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.9 mt -96.32 121.19 37.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.451 HD21 HG23 ' A' ' 95' ' ' THR . 1.9 m-80 -111.68 123.71 50.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 0.0 110.731 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.407 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 27.1 p90 -166.95 141.58 3.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.037 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.582 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.5 p -83.6 112.69 21.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.689 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -75.7 -97.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.674 -178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -74.05 -36.29 64.36 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.777 0.322 . . . . 0.0 110.943 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.44 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.7 t-20 178.98 24.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.218 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.802 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.6 tptt -155.32 126.95 3.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 110.891 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.906 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.3 Cg_endo -69.5 119.89 6.79 Favored 'Trans proline' 0 CA--C 1.515 -0.438 0 C-N-CA 123.437 2.758 . . . . 0.0 112.876 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.982 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.9 mmmt -101.51 129.39 47.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.04 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.451 HG23 HD21 ' A' ' 86' ' ' ASN . 24.2 m -95.49 114.62 26.4 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.763 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.4 t -113.75 107.76 23.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.95 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.37 120.33 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.694 ' HB3' HG13 ' A' ' 14' ' ' ILE . 8.5 m-85 -104.17 128.53 51.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.042 0.448 . . . . 0.0 111.705 -178.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.588 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 7.9 m-90 -114.4 152.8 30.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.437 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.583 HD21 ' CE1' ' A' ' 81' ' ' PHE . 1.1 mt -88.59 121.37 30.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.8 144.71 51.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.561 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.9 tt0 -122.83 113.85 19.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.387 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.936 HG12 HD23 ' A' ' 75' ' ' LEU . 17.4 m -72.78 115.45 13.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 121.399 0.619 . . . . 0.0 110.869 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.517 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -60.24 -26.74 66.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.662 -178.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.914 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 2.1 m-20 -93.8 110.1 21.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.19 0.519 . . . . 0.0 111.501 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -58.38 -38.49 77.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.09 26.13 9.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.807 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.914 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.9 p -47.85 149.45 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.419 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -73.39 142.31 46.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.134 0.493 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.77 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.9 mm -118.27 99.65 8.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.618 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.1 OUTLIER -103.2 97.96 7.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.127 -179.457 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 34' ' ' LEU . 5.5 mt -84.71 -177.75 6.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.775 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 67' ' ' GLU . 0.3 OUTLIER -120.44 -166.14 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.677 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -68.58 -14.99 63.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.685 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.61 23.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.687 0.279 . . . . 0.0 111.405 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 84.0 m-70 -119.76 122.08 40.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.899 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -103.75 -7.67 20.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.601 -179.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -165.7 154.78 11.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.047 0.451 . . . . 0.0 111.24 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.77 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.6 p90 -134.45 171.61 14.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.493 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -157.78 157.82 34.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.211 0.529 . . . . 0.0 111.506 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.581 ' C ' ' HG2' ' A' ' 30' ' ' GLU . 73.3 m95 -122.47 109.55 14.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.521 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.715 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.94 170.67 15.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.007 0.432 . . . . 0.0 111.458 -178.651 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.43 -155.13 4.95 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.075 179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.2 tp -75.17 -41.23 58.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.652 0.263 . . . . 0.0 111.084 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.3 pt-20 -62.3 -51.24 68.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.715 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -70.37 -45.54 65.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.0 0.428 . . . . 0.0 110.479 -179.525 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.577 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -57.73 -29.98 65.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.238 0.542 . . . . 0.0 109.692 178.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 4.2 m -83.91 -32.1 25.3 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.32 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.9 OUTLIER -64.59 -44.27 91.16 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.694 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -77.13 -43.98 32.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.923 179.119 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.27 53.61 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.91 -30.57 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.571 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 12.1 m-85 -60.28 118.49 6.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.426 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -46.4 -46.62 18.69 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.237 0.541 . . . . 0.0 111.693 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.9 mp0 -50.84 -54.46 23.58 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.981 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.793 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.19 -42.62 99.46 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.136 -179.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -34.7 40.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 110.148 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.559 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.75 -47.45 25.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.939 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 1.002 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.94 -41.73 62.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.088 0.47 . . . . 0.0 110.207 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.55 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -78.69 -28.18 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.601 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -66.36 -52.02 51.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.05 -32.77 69.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.483 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.07 -39.78 90.29 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.215 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.6 OUTLIER -80.4 -31.25 37.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.863 0.363 . . . . 0.0 110.588 179.652 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.54 -52.55 57.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.366 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.01 -53.55 48.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.927 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.592 ' CD2' HG12 ' A' ' 78' ' ' ILE . 86.8 mt -55.35 -39.79 70.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.921 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 14.5 t -60.75 -15.64 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.713 0.292 . . . . 0.0 110.888 179.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.45 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.089 0.471 . . . . 0.0 111.646 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.914 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.75 130.4 54.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.602 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.619 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.07 111.95 19.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.864 179.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.806 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -124.71 173.45 8.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.887 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 6.5 m -161.73 124.06 2.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.14 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -115.06 170.67 13.34 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.615 HD11 HD23 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -122.72 117.95 26.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.478 0.639 . . . . 0.0 111.687 -179.438 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.916 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.1 mt -82.24 91.17 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.638 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 177.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.916 HD11 HG23 ' A' ' 64' ' ' THR . 19.6 mt -79.57 143.23 12.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.833 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.726 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 32.7 p90 -148.5 122.26 9.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.277 -178.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 103' ' ' VAL . 63.2 mtm180 -80.79 114.2 19.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.435 ' H ' ' HG3' ' A' ' 102' ' ' GLU . 15.9 ttm180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.81 -178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.718 0.294 . . . . 0.0 111.741 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.726 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.3 mt -102.27 151.13 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.411 0.624 . . . . 0.0 112.377 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.664 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 41.8 mt-10 -135.33 139.69 44.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.422 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.9 m-85 -101.36 152.42 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 23.6 tp -85.17 138.59 32.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.931 179.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.3 mt -138.37 136.22 36.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.502 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.703 HD11 ' HG3' ' A' ' 46' ' ' PRO . 13.6 mt -113.84 113.04 24.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.654 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 6.2 tp60 -66.12 126.6 29.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 110.868 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.049 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 120.929 0.395 . . . . 0.0 111.233 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.664 ' HB3' HD22 ' A' ' 33' ' ' LEU . 77.0 m95 -112.81 120.31 41.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.532 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.581 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.9 OUTLIER -145.32 130.91 9.39 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 31.2 Cg_exo -58.49 175.95 0.48 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.075 1.85 . . . . 0.0 111.594 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.721 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.8 Cg_exo -57.78 105.02 0.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.501 2.134 . . . . 0.0 112.78 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HE3' ' HB ' ' A' ' 44' ' ' THR . 8.9 mtmp? -101.22 144.73 29.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.704 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.463 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -122.82 -162.67 11.6 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.564 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.54 96.0 3.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.94 0.4 . . . . 0.0 110.642 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.695 ' N ' HG21 ' A' ' 59' ' ' THR . 2.1 p -77.88 132.85 31.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.828 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.57 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -96.98 179.17 1.16 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.107 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.1 Cg_exo -57.01 -59.06 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.145 1.897 . . . . 0.0 112.593 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.65 2.29 87.55 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.47 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.52 ' H ' ' HG2' ' A' ' 51' ' ' GLU . 9.7 tt0 -80.21 174.01 12.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.789 0.328 . . . . 0.0 110.6 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.858 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.7 t70 -94.39 153.77 17.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.216 0.532 . . . . 0.0 110.432 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.603 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -72.14 -63.37 1.15 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.286 -179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 77' ' ' ILE . 20.7 tp -63.97 -39.54 94.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.618 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.858 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.76 -49.93 56.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.666 0.27 . . . . 0.0 110.745 -179.782 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.695 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.5 m -54.03 -40.8 67.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.505 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -73.79 -28.73 61.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 178.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.709 HD22 ' HB2' ' A' ' 72' ' ' ALA . 90.1 mt -74.94 -53.49 8.91 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.75 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -59.81 -38.22 81.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.419 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.89 -36.11 82.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.023 0.44 . . . . 0.0 109.962 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.916 HG23 HD11 ' A' ' 15' ' ' ILE . 14.0 m -60.13 -55.91 28.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.597 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.571 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -70.16 -22.11 63.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.868 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -79.06 -40.19 31.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.897 0.38 . . . . 0.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 96.1 mt-10 -109.91 11.24 24.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.44 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -155.47 -6.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.51 0.31 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.819 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.763 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.7 mt -103.06 121.14 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 117.049 0.425 . . . . 0.0 110.48 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.4 pt-20 -108.66 173.27 6.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.082 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.97 -37.58 32.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.381 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.36 -16.14 73.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.153 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.512 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 1.6 tp60 -102.49 -4.41 25.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.524 0.202 . . . . 0.0 111.261 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -134.39 -174.07 3.46 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.857 0.36 . . . . 0.0 110.219 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.556 ' H ' ' H ' ' A' ' 102' ' ' GLU . 51.4 m -130.48 100.96 5.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.29 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 57' ' ' LEU . 14.7 mm -74.1 129.34 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.397 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.514 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -92.27 139.58 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.528 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -98.74 151.41 20.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.0 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -26.42 24.15 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.453 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.611 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 11.1 t80 -104.3 127.35 51.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.017 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.465 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.4 ttpt -158.12 125.7 5.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.154 0.502 . . . . 0.0 111.662 179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 139.91 25.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.551 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.896 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.7 OUTLIER -120.96 132.84 55.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.921 0.391 . . . . 0.0 111.429 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.8 mt -98.25 116.93 31.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.615 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.5 m-80 -107.22 125.38 51.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.378 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -167.37 143.18 4.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.092 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.593 HG23 ' CA ' ' A' ' 92' ' ' LYS . 8.3 p -83.66 106.45 14.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.626 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.23 -101.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.837 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 6.0 ptt180 -57.16 -41.41 79.15 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.424 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 6.6 p-10 172.55 29.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.376 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -157.73 128.96 3.75 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.292 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.914 ' O ' HD12 ' A' ' 8' ' ' LEU . 40.8 Cg_endo -66.86 121.33 8.52 Favored 'Trans proline' 0 CA--C 1.514 -0.48 0 C-N-CA 123.287 2.658 . . . . 0.0 112.525 -179.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.806 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -104.92 123.65 48.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.895 -178.63 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 97.4 m -91.24 106.31 18.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.6 t -108.5 108.46 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.896 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.58 127.54 40.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.658 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.0 m-85 -115.35 130.0 56.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.603 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 15.0 m-90 -111.09 169.65 8.63 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.134 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 81' ' ' PHE . 1.1 mt -102.95 112.32 25.09 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.34 151.2 40.38 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.556 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.6 tt0 -125.88 112.24 15.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.414 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.768 HG12 HD23 ' A' ' 75' ' ' LEU . 5.0 m -72.07 112.92 8.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.548 0.69 . . . . 0.0 110.79 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 2.0 ptpt -58.01 -27.16 63.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.225 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.899 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 16.2 m-20 -94.32 111.06 22.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.203 0.525 . . . . 0.0 111.593 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.454 ' CE1' ' NH1' ' A' ' 17' ' ' ARG . 17.0 t80 -57.67 -39.99 78.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.422 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -103.86 27.34 7.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.715 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.899 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -46.9 151.53 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.749 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.535 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.2 OUTLIER -76.8 144.75 38.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.294 0.568 . . . . 0.0 111.231 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.875 HG21 ' CD1' ' A' ' 119' ' ' TYR . 44.9 mm -121.63 99.3 6.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.967 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.68 ' HD2' ' N ' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -98.77 101.83 13.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.926 -178.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.591 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.4 mt -95.94 140.41 30.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.73 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.7 p -83.08 -164.94 0.95 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.414 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -72.86 -4.53 32.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.501 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -91.47 -22.89 20.18 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.603 0.239 . . . . 0.0 111.426 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 94.2 m-70 -120.84 129.36 53.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.017 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -98.74 -12.53 20.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.573 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.39 173.73 6.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.418 . . . . 0.0 111.436 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.875 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.8 p90 -146.68 174.64 11.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.578 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 49.7 mtt180 -156.12 153.6 29.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 111.745 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 95.2 m95 -119.02 107.67 13.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.276 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.2 167.42 21.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 111.51 -178.654 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.67 -152.6 3.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.1 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' CD ' ' A' ' 141' ' ' GLN . 8.4 tp -77.25 -43.42 33.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.684 0.278 . . . . 0.0 111.292 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.2 pt-20 -59.91 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.665 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.892 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.28 -43.76 60.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.055 -179.434 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.45 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -59.36 -29.82 67.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.361 0.601 . . . . 0.0 109.747 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.7 m -84.84 -33.71 22.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.49 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.892 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.67 -43.51 84.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.586 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -75.27 -45.73 38.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 127' ' ' ALA . . . -80.43 54.44 2.04 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.105 0.479 . . . . 0.0 109.865 178.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.0 -33.59 0.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.566 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.534 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 4.4 m-85 -54.2 119.52 5.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.108 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -45.98 -47.72 16.61 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.302 0.572 . . . . 0.0 111.354 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.922 ' HB3' HD13 ' A' ' 85' ' ' LEU . 26.0 mp0 -49.66 -57.14 7.77 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.911 -179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.451 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.14 -46.86 87.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.398 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.02 -41.36 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.169 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.97 -47.38 65.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.411 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.916 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.15 -41.98 63.01 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.38 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.45 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.4 OUTLIER -81.65 -28.19 33.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.119 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.532 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.63 -52.56 43.76 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.22 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.611 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -74.47 -25.37 59.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 -179.769 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.531 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.53 -47.64 88.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.472 -0.871 . . . . 0.0 111.771 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.684 ' NE2' HD12 ' A' ' 29' ' ' ILE . 5.9 t-160 -76.08 -29.67 58.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.962 0.41 . . . . 0.0 110.655 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -68.95 -52.81 25.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -61.52 -47.57 85.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.856 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.59 ' HG ' HD13 ' A' ' 100' ' ' LEU . 65.0 mt -54.29 -44.48 71.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.593 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.6 -11.99 59.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.926 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.439 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.625 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.519 -0.222 0 CA-C-O 121.251 0.548 . . . . 0.0 111.362 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.947 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -111.09 138.66 47.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.01 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.766 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -84.25 112.84 20.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.578 179.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 95' ' ' THR . . . -124.71 170.73 10.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.258 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -163.16 124.48 2.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.087 0.47 . . . . 0.0 111.115 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.639 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -118.52 177.61 16.5 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.583 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -131.2 118.12 19.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.028 0.414 . . . . 0.0 111.762 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.783 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.4 mt -82.73 92.08 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 32.7 mt -83.73 145.16 8.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.444 -177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.744 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.2 122.47 7.21 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.284 -179.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.65 112.94 18.49 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.124 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.509 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.436 -179.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.781 0.324 . . . . 0.0 111.35 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.744 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -115.12 146.44 19.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.239 0.542 . . . . 0.0 112.149 -179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.605 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 20.5 mt-10 -136.35 129.68 31.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.926 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.642 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 63.7 m-85 -91.64 150.01 21.36 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.62 HD23 HD12 ' A' ' 15' ' ' ILE . 55.1 tp -84.82 133.73 34.32 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -134.98 141.18 46.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.639 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.603 HD11 ' HG3' ' A' ' 46' ' ' PRO . 14.4 mt -119.09 121.47 39.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.184 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.464 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 39.4 tt0 -61.42 162.48 7.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.59 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.795 -179.949 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.914 0.387 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.707 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 40.8 m95 -101.66 119.79 39.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -139.59 141.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.797 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.94 166.48 2.99 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.516 2.144 . . . . 0.0 112.09 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 24.3 Cg_exo -63.33 82.67 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.751 2.301 . . . . 0.0 112.132 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.458 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 12.8 pttm -87.05 156.22 19.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.085 0.469 . . . . 0.0 111.335 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.23 -178.86 19.42 Favored Glycine 0 N--CA 1.45 -0.371 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.302 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.478 ' NE2' ' HB3' ' A' ' 8' ' ' LEU . 4.8 t-80 -108.49 118.69 37.43 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.766 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -93.06 134.79 29.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.256 0.55 . . . . 0.0 111.25 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.696 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 5.1 tt0 -93.52 152.06 40.63 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.878 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.5 Cg_endo -54.23 -22.04 24.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.644 2.23 . . . . 0.0 112.58 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.696 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.07 -14.35 36.56 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.795 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -83.06 168.15 17.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.66 0.267 . . . . 0.0 110.671 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 1.047 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 27.4 t70 -85.69 161.65 19.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.114 0.483 . . . . 0.0 110.747 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.52 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -72.05 -63.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 -179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.601 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 22.7 tp -66.66 -39.4 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.962 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 1.047 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.3 tt0 -49.69 -46.76 50.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.452 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 96.9 m -58.85 -47.59 84.33 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -65.75 -29.81 70.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.085 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.834 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.8 mt -72.18 -53.53 12.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.948 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -64.02 -33.05 74.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.567 -179.85 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.95 -32.15 72.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.028 0.442 . . . . 0.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 23.1 m -60.46 -51.17 70.61 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.499 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.531 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -75.54 -20.6 58.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.07 179.673 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.3 tm-20 -78.32 -38.28 42.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.056 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.608 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 96.3 mt-10 -110.25 -0.66 17.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.8 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -141.37 -10.9 0.94 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.647 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 75.26 -4.51 40.3 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.111 -1.042 . . . . 0.0 113.088 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.851 HD11 ' CD1' ' A' ' 110' ' ' ILE . 4.5 mt -100.71 126.95 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.085 0.469 . . . . 0.0 111.278 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.0 pt-20 -109.96 170.44 8.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.786 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.98 -38.89 11.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.039 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.95 -22.77 70.69 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.247 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.594 ' HG2' HG23 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -98.67 -1.9 39.63 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.476 0.179 . . . . 0.0 111.244 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -136.95 -169.63 2.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.201 178.148 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.589 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 24.4 m -136.34 99.68 4.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.609 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.597 HG21 HD21 ' A' ' 57' ' ' LEU . 8.4 mm -72.01 123.57 26.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.968 0.413 . . . . 0.0 111.009 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.515 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.87 139.23 17.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.777 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -98.75 151.7 20.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.097 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.1 -23.75 33.48 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.06 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.575 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 7.4 t80 -108.88 127.24 53.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -159.01 127.79 5.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.214 0.53 . . . . 0.0 111.645 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.469 HH12 ' HG2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -153.81 141.52 20.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.851 179.099 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.862 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.86 132.53 54.62 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.178 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 135' ' ' GLU . 10.7 mt -94.54 118.74 32.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.351 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.415 HD22 ' HA ' ' A' ' 95' ' ' THR . 2.5 m120 -105.72 126.02 51.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -166.57 141.09 4.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.021 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.599 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.2 p -80.72 113.33 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.878 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -76.19 -107.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.369 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -61.65 -42.35 98.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.964 0.411 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -176.69 26.83 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.808 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.48 128.18 4.15 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.761 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.6 Cg_endo -72.22 116.0 4.54 Favored 'Trans proline' 0 CA--C 1.506 -0.895 0 C-N-CA 123.173 2.582 . . . . 0.0 112.404 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.668 ' HD3' ' CG2' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -105.93 122.2 45.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.791 -179.205 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.583 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 22.9 m -79.47 120.27 23.64 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.708 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 9.5 t -115.0 108.72 26.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.815 -178.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.862 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.42 133.59 29.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.716 ' HB3' HG13 ' A' ' 14' ' ' ILE . 77.6 m-85 -118.11 129.85 55.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.107 0.48 . . . . 0.0 111.743 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 10.6 m-90 -117.47 139.57 50.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.934 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.496 HD12 HG21 ' A' ' 78' ' ' ILE . 1.1 mt -76.58 116.17 17.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -126.94 146.37 50.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 110.681 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.57 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.1 tm-20 -122.77 116.93 24.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.551 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 12.9 m -73.12 120.65 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.371 0.605 . . . . 0.0 110.422 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -28.96 69.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.121 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.783 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 51.4 t0 -98.72 128.21 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.064 0.459 . . . . 0.0 111.978 -179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.56 -42.24 61.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.436 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -91.25 19.7 5.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.483 178.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.783 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.4 p -47.69 143.58 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.927 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -66.35 142.55 57.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.468 0.652 . . . . 0.0 111.649 -178.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.851 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.96 95.36 3.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.953 179.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.647 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.3 mtp180 -95.22 101.34 13.07 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.727 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.75 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 12.2 mt -95.42 151.88 18.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.86 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.3 m -81.38 -169.03 2.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.109 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.25 6.12 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.535 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -102.23 -32.11 10.23 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.612 0.244 . . . . 0.0 111.149 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.75 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.3 m80 -97.16 113.47 25.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.974 0.416 . . . . 0.0 111.078 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -76.19 -19.46 58.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.699 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.77 -177.12 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.0 111.94 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.709 ' CG ' HG21 ' A' ' 110' ' ' ILE . 36.3 p90 -151.01 162.73 40.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.992 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.707 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -150.67 141.64 22.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.266 0.555 . . . . 0.0 111.681 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -98.79 107.64 20.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.222 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.09 168.31 19.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.814 -177.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.5 -152.02 4.17 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.599 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.469 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.7 tp -77.0 -40.94 44.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.826 0.346 . . . . 0.0 111.044 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 15.6 pt-20 -61.0 -51.18 70.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.866 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.719 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -72.69 -32.97 66.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 0.0 110.703 -179.334 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.533 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -69.91 -29.69 66.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.357 0.599 . . . . 0.0 109.497 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.43 -31.36 24.66 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.429 178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.7 OUTLIER -66.64 -45.51 78.78 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.782 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.8 mt -74.09 -44.82 52.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.67 51.98 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.191 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.488 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.1 -28.35 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.67 -179.494 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -58.11 117.41 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.405 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.523 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 1.2 tttm -46.06 -44.98 15.85 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 111.778 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.763 ' HB3' HD13 ' A' ' 85' ' ' LEU . 20.9 mp0 -53.47 -53.36 52.51 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.624 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.97 -49.64 75.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.746 0.308 . . . . 0.0 111.394 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.523 ' HZ2' ' HA ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -48.65 -39.61 24.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.11 179.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.88 -46.45 57.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.069 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.783 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.7 -41.47 66.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.161 0.505 . . . . 0.0 109.972 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.47 -27.93 41.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.174 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.01 -52.6 40.51 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.568 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.575 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 2.4 mp0 -73.75 -25.48 60.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.572 -179.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.459 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -62.09 -43.12 99.59 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.378 -0.915 . . . . 0.0 111.108 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.462 ' NE2' HD12 ' A' ' 29' ' ' ILE . 4.8 t-80 -79.75 -31.92 41.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.027 0.442 . . . . 0.0 109.995 178.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . 0.405 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 13.6 tp60 -65.53 -50.88 63.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.743 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -63.16 -50.51 70.11 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.732 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.515 ' CD2' HG12 ' A' ' 78' ' ' ILE . 97.8 mt -55.67 -30.6 61.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.98 -18.83 60.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.691 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.422 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.141 0 CA-C-O 121.265 0.555 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.895 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -117.92 140.31 49.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.809 178.839 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.702 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -84.56 133.11 34.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.748 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.453 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -150.66 166.34 30.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.596 179.281 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 96.4 m -155.25 124.59 6.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.916 0.388 . . . . 0.0 111.515 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.627 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -112.06 172.59 14.89 Favored Glycine 0 N--CA 1.452 -0.292 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 178.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.61 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -127.14 117.76 23.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.294 0.547 . . . . 0.0 111.487 -179.931 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.94 HD11 ' HB1' ' A' ' 139' ' ' ALA . 74.3 mt -84.03 91.53 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.038 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 10.3 mt -83.11 146.2 7.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.172 -178.501 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.753 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.6 p90 -151.82 122.95 7.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.961 -178.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.771 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.83 111.64 17.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.949 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.257 0 CA-C-O 120.716 0.293 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.753 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 11.2 mt -99.58 147.83 6.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.376 0.607 . . . . 0.0 111.866 -179.17 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.7 mt-10 -136.74 122.94 20.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.306 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.6 m-85 -87.39 141.91 28.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.934 -178.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.56 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 38.3 tp -79.97 133.61 36.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -136.65 137.0 39.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.538 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.562 HD22 HD22 ' A' ' 112' ' ' LEU . 12.6 mt -113.8 125.9 54.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.985 -179.533 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.561 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 2.1 tt0 -57.82 168.61 0.88 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.394 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.126 -179.985 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.577 ' O ' HG23 ' A' ' 44' ' ' THR . 50.6 m95 -111.7 135.6 52.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.021 -179.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 ' O ' ' A' ' 43' ' ' TRP . 6.6 p -160.95 147.72 11.79 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.671 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.439 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 23.8 Cg_endo -61.36 169.44 6.51 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.574 2.183 . . . . 0.0 112.202 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 63.6 Cg_endo -75.54 108.59 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.798 2.332 . . . . 0.0 112.388 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.0 pttp -106.36 141.15 38.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 111.295 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 63' ' ' ALA . . . -110.83 -161.74 17.77 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.964 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -130.04 105.12 7.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.702 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -78.22 113.93 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 121.295 0.569 . . . . 0.0 110.976 -179.783 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.653 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -74.52 177.99 1.93 Allowed Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.578 -179.919 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.653 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.3 Cg_exo -56.84 -50.04 12.76 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.338 2.026 . . . . 0.0 112.771 -179.518 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -96.06 12.88 66.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.908 -179.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -86.5 167.29 14.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.994 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.3 t70 -92.21 158.71 16.0 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.18 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.47 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 2.9 m-20 -73.08 -61.46 1.81 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.304 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.679 HD13 ' CD2' ' A' ' 99' ' ' TRP . 17.9 tp -63.2 -39.78 95.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 0.0 110.935 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.84 -50.78 44.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 110.862 -179.897 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.58 HG21 ' N ' ' A' ' 50' ' ' VAL . 56.3 m -55.63 -41.49 73.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.59 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.25 -30.32 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.996 178.357 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.75 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.9 mt -72.76 -52.25 15.81 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.272 179.133 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.47 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.58 -40.65 95.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.811 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.456 ' HB2' ' CA ' ' A' ' 48' ' ' GLY . . . -60.31 -36.5 78.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -59.78 -58.07 10.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.855 179.299 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.556 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.7 pt20 -68.91 -21.8 64.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.47 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 22.5 mt-10 -79.03 -42.87 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.358 . . . . 0.0 110.958 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.58 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.8 mp0 -103.79 1.78 32.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.742 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.54 -5.87 0.73 Allowed 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -179.804 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.7 -1.59 9.61 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.141 -1.028 . . . . 0.0 112.811 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.736 ' O ' HG22 ' A' ' 64' ' ' THR . 1.6 mt -103.06 125.07 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.308 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -111.38 173.55 6.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.741 -179.619 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.42 -38.27 28.54 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.629 179.402 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.71 -14.46 60.57 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.449 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -106.98 -15.44 14.7 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.821 0.311 . . . . 0.0 111.453 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.833 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -123.65 -175.13 3.14 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.939 0.399 . . . . 0.0 110.449 178.623 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.546 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 43.0 m -129.27 100.76 5.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.094 -179.58 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.672 HG21 HD21 ' A' ' 57' ' ' LEU . 13.2 mm -72.82 115.09 13.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.762 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.474 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -75.91 136.01 25.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -93.76 151.61 19.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.338 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.24 -23.51 35.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.292 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.757 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.7 t80 -107.29 127.03 53.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.789 0.328 . . . . 0.0 111.174 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.6 ttpt -158.72 125.12 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 179.637 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.92 145.05 31.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.085 179.403 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.83 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.9 OUTLIER -126.17 126.38 44.01 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.224 179.852 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.7 mt -90.68 120.06 31.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 1.9 m-80 -110.47 124.22 51.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 -179.499 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -166.87 137.85 3.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.966 0.412 . . . . 0.0 111.126 -179.862 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.569 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -76.33 113.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.345 0.593 . . . . 0.0 110.889 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.82 -105.56 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.819 -178.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 1.6 ptt-85 -63.45 -35.92 82.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.978 0.418 . . . . 0.0 110.394 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 90' ' ' ARG . 9.6 t-20 176.28 27.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.969 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.794 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.27 128.04 3.87 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 0.0 110.981 -179.968 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.895 ' O ' HD12 ' A' ' 8' ' ' LEU . 44.0 Cg_endo -70.18 118.69 5.83 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.422 2.748 . . . . 0.0 113.099 -179.226 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.862 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.2 mmmt -99.26 130.2 45.54 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.144 -179.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.422 HG23 HD21 ' A' ' 86' ' ' ASN . 17.8 m -95.6 107.16 19.33 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.748 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 44.8 t -107.13 108.0 24.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.789 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.83 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.13 128.71 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.519 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.577 ' HB3' HG13 ' A' ' 14' ' ' ILE . 10.6 m-85 -108.54 163.25 13.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.334 0.588 . . . . 0.0 111.439 -178.83 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.679 ' CD2' HD13 ' A' ' 57' ' ' LEU . 2.8 m-90 -150.75 136.23 17.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.172 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.757 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -76.97 114.6 15.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.11 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -125.86 151.46 46.82 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 120.749 0.309 . . . . 0.0 111.305 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.527 ' H ' ' H ' ' A' ' 76' ' ' THR . 0.3 OUTLIER -124.86 113.35 17.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.163 -179.598 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.833 HG12 HD23 ' A' ' 75' ' ' LEU . 10.5 m -71.92 122.83 25.06 Favored 'Isoleucine or valine' 0 C--N 1.338 0.07 0 CA-C-O 121.171 0.51 . . . . 0.0 110.323 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 2.1 mttt -65.26 -21.55 66.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.98 -178.12 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.815 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 5.9 m-20 -102.67 113.15 26.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.221 0.534 . . . . 0.0 111.624 -179.048 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.424 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 13.4 t80 -58.56 -38.33 77.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.237 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -103.24 23.3 12.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.548 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.815 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.1 p -42.99 148.83 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.826 -179.529 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.694 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 15.5 pm0 -73.22 141.76 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.273 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.711 ' CD1' HD11 ' A' ' 70' ' ' ILE . 36.6 mm -120.43 105.19 16.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.634 179.086 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.694 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -103.38 97.44 7.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.59 -179.241 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.659 HD11 ' HD1' ' A' ' 119' ' ' TYR . 3.3 mt -95.75 144.46 26.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.357 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 115' ' ' GLU . 2.7 p -94.06 -169.36 2.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.606 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . 0.501 ' H ' ' CD2' ' A' ' 114' ' ' HIS . 4.4 p80 -67.55 10.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.689 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.4 mt-10 -100.88 -30.48 11.65 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.72 0.295 . . . . 0.0 110.887 179.431 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.406 ' ND1' ' HB2' ' A' ' 34' ' ' LEU . 26.1 m-70 -124.78 124.0 41.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.889 0.376 . . . . 0.0 110.942 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.47 -17.57 44.77 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.5 -179.932 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -163.46 -176.56 4.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.241 0.544 . . . . 0.0 111.507 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.678 ' CE2' HG13 ' A' ' 110' ' ' ILE . 31.9 p90 -153.59 172.38 17.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.325 -179.589 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -157.9 157.87 33.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.118 0.485 . . . . 0.0 111.03 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.56 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 83.5 m95 -122.31 107.06 11.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.382 178.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.82 165.09 26.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 0.0 111.567 -178.402 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.53 -154.14 1.21 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.819 179.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.8 tp -76.73 -43.67 36.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.836 0.35 . . . . 0.0 110.745 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -57.36 -51.63 68.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.614 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.668 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.62 -53.08 20.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.811 0.338 . . . . 0.0 110.244 -179.887 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.459 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.04 -27.41 7.93 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.442 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.5 OUTLIER -82.69 -35.25 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.511 178.392 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -63.55 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.5 -179.642 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.606 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -77.91 -39.77 41.87 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.265 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -80.03 47.8 0.92 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 179.285 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.19 -29.34 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.726 -179.861 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.458 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -59.69 119.83 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.421 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -46.46 -46.24 18.77 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.218 0.532 . . . . 0.0 111.847 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 1.009 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.1 mp0 -52.7 -56.39 15.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.893 -178.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.496 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -59.43 -41.0 88.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.571 0.224 . . . . 0.0 111.446 -179.347 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.59 -42.3 64.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.103 179.455 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.575 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.11 -47.62 67.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.608 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.34 -49.1 62.07 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.92 0.391 . . . . 0.0 110.206 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -74.36 -26.81 60.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.319 178.887 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.06 -52.72 32.07 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.095 -179.818 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 3.1 mm-40 -68.79 -29.17 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.264 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.438 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.71 -48.46 84.83 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.854 179.379 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.457 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -74.55 -28.95 61.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.887 0.375 . . . . 0.0 110.743 179.579 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 8.1 tp60 -68.35 -51.46 44.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.481 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -65.43 -51.21 61.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.996 0.427 . . . . 0.0 110.953 -179.714 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.474 ' CD2' HG12 ' A' ' 78' ' ' ILE . 93.9 mt -56.33 -32.29 64.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.899 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 4.2 t -75.98 -14.03 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.0 110.714 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.784 -179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.646 ' HB1' ' O ' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.521 -0.157 0 CA-C-O 121.204 0.526 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.18 131.26 56.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.354 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.548 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -82.89 132.39 35.16 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.673 -178.907 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.681 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -145.1 163.22 34.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.507 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 56.7 m -154.52 124.31 6.65 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.029 0.443 . . . . 0.0 111.732 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.26 171.49 13.87 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.534 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -122.57 117.89 26.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.28 0.54 . . . . 0.0 112.44 -179.174 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.826 HD11 ' HB1' ' A' ' 139' ' ' ALA . 54.2 mt -80.73 92.12 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.781 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.287 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.867 HD11 HG23 ' A' ' 64' ' ' THR . 27.2 mt -84.4 146.88 6.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.706 -178.035 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.78 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.6 p90 -153.88 121.15 5.76 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.288 -179.385 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' CG ' ' HB2' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -79.74 114.42 18.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.518 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.465 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.127 -179.112 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.167 0 CA-C-O 120.959 0.409 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.78 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.7 mt -111.14 141.11 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.056 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.673 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.1 mt-10 -133.89 127.25 32.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.046 179.102 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.678 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -87.09 154.37 20.8 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.5 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 15' ' ' ILE . 39.2 tp -90.73 135.01 33.99 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.843 178.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 127' ' ' ALA . 5.9 mt -135.11 142.02 46.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.757 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 112' ' ' LEU . 14.5 mt -121.81 107.42 12.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HB2' ' CD2' ' A' ' 43' ' ' TRP . 37.3 tt0 -67.71 141.77 56.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.179 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.191 179.964 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 120.849 0.357 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.697 ' O ' HG23 ' A' ' 44' ' ' THR . 37.5 m95 -98.11 150.1 21.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.035 179.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.77 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -171.54 144.02 1.56 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.524 -179.728 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.484 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 32.8 Cg_exo -61.56 165.63 13.1 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.356 2.037 . . . . 0.0 112.171 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.12 102.07 0.2 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.484 2.123 . . . . 0.0 112.443 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -87.92 155.44 19.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.907 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.511 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -138.13 174.29 22.0 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.206 179.828 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -115.81 103.53 10.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.677 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.666 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -81.3 127.37 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.302 0.572 . . . . 0.0 111.363 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.0 tt0 -88.46 153.24 50.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.291 179.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 12.5 Cg_endo -55.57 -18.74 21.07 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.985 2.456 . . . . 0.0 112.585 -179.525 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.632 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -107.54 -6.67 32.99 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.926 179.213 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -88.75 176.48 7.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.925 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -92.7 161.41 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.029 0.442 . . . . 0.0 109.991 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 24.3 m-20 -73.7 -61.06 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.849 -179.099 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.652 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 36.6 tp -65.91 -40.01 91.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.74 0.305 . . . . 0.0 110.831 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.925 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.15 -47.15 54.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.79 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.666 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.1 m -58.0 -43.6 86.72 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -69.94 -32.7 71.11 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.019 178.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.2 mt -71.11 -51.77 23.18 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.491 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.2 OUTLIER -61.78 -41.03 97.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.011 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.22 -34.78 77.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.163 0.506 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.867 HG23 HD11 ' A' ' 15' ' ' ILE . 93.5 m -60.08 -51.39 69.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.434 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.535 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.0 pt20 -76.85 -21.81 54.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.515 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -78.27 -35.03 48.59 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.304 . . . . 0.0 110.73 179.193 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 2.0 mp0 -108.18 -14.24 14.75 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.5 -8.79 4.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.691 0.281 . . . . 0.0 111.632 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.973 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.54 -8.65 25.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.236 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.795 HG23 ' HG2' ' A' ' 74' ' ' GLN . 3.2 mt -94.22 123.4 46.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.012 -179.677 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pm0 -103.54 169.38 8.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.023 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.929 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -45.89 -39.13 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.364 179.719 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.95 -23.02 74.32 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.382 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.795 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -95.76 1.39 53.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.726 0.298 . . . . 0.0 111.324 -179.994 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -137.69 -166.41 1.95 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.692 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -140.57 98.52 3.43 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.57 HG13 HD21 ' A' ' 61' ' ' LEU . 9.4 mm -73.24 114.2 12.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.074 0.464 . . . . 0.0 111.778 -179.848 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.667 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -77.05 138.13 21.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.62 179.322 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -97.52 148.82 22.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.403 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.93 -24.64 27.7 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.12 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.674 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 12.1 t80 -104.35 127.43 52.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.836 0.35 . . . . 0.0 111.146 -179.842 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.521 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -158.94 128.19 5.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.261 0.553 . . . . 0.0 111.31 179.577 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.4 tpt85 -154.53 137.86 15.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.95 179.294 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.844 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -120.83 136.13 54.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.169 0.509 . . . . 0.0 111.455 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.96 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.6 mt -95.24 118.21 31.61 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.168 179.163 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.621 HD21 HG23 ' A' ' 95' ' ' THR . 1.9 m-80 -108.34 126.3 52.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.735 -179.261 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.4 p90 -167.0 141.0 3.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 -179.633 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.661 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.9 p -80.7 113.57 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.53 0.681 . . . . 0.0 110.64 179.294 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.61 -102.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.352 -178.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.432 HH11 ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -77.48 -35.01 54.14 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 120.964 0.412 . . . . 0.0 110.312 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -172.89 16.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.603 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.819 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -148.6 126.38 5.76 Favored Pre-proline 0 N--CA 1.451 -0.384 0 CA-C-O 120.945 0.402 . . . . 0.0 111.365 -179.616 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.836 ' O ' HD12 ' A' ' 8' ' ' LEU . 50.6 Cg_endo -69.06 118.71 5.84 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.615 2.877 . . . . 0.0 113.234 -179.52 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 4.6 mmmt -101.39 124.76 47.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.331 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.621 HG23 HD21 ' A' ' 86' ' ' ASN . 27.2 m -89.4 114.93 26.45 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.719 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 37.5 t -113.52 108.03 24.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.759 -178.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.844 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.35 132.5 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.695 ' HB3' HG13 ' A' ' 14' ' ' ILE . 43.0 m-85 -118.66 129.97 55.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.126 0.488 . . . . 0.0 111.656 -178.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.652 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 1.1 m-90 -118.47 142.62 47.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.387 179.47 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 HG21 ' A' ' 78' ' ' ILE . 1.5 mt -76.07 123.09 25.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -133.85 134.39 42.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.441 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.63 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.4 tt0 -114.78 115.15 26.56 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.182 -179.533 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.804 HG12 HD23 ' A' ' 75' ' ' LEU . 16.6 m -72.05 108.29 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-O 121.547 0.689 . . . . 0.0 110.143 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -57.07 -13.04 2.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.974 -178.774 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.2 t0 -107.87 116.6 32.24 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.012 0.434 . . . . 0.0 111.347 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -65.59 -38.96 90.99 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.323 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.39 25.74 6.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.511 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.1 p -51.37 146.33 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.87 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.1 pm0 -74.12 145.84 44.01 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.065 -179.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.794 HD13 HD11 ' A' ' 70' ' ' ILE . 32.7 mm -122.47 101.22 9.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.951 179.389 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.973 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -102.11 97.03 7.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.095 -179.468 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 34' ' ' LEU . 6.1 mt -90.03 150.53 22.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.801 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.2 t -83.86 -168.13 2.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.09 1.58 10.79 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.552 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -98.83 -29.14 13.14 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.591 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.6 m80 -109.11 110.81 22.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.769 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -89.53 -6.73 56.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.842 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -170.61 152.62 3.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.107 0.48 . . . . 0.0 111.838 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.725 ' CE2' HG13 ' A' ' 110' ' ' ILE . 32.7 p90 -133.23 175.81 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.306 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.607 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -157.54 166.32 33.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.368 0.604 . . . . 0.0 111.798 179.801 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.407 ' CE3' ' HG2' ' A' ' 17' ' ' ARG . 83.5 m95 -131.01 106.75 8.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.335 178.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.761 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -137.38 170.17 16.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.205 0.526 . . . . 0.0 111.518 -178.441 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.71 -153.26 3.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.706 179.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.438 HD21 ' NE2' ' A' ' 141' ' ' GLN . 8.5 tp -77.23 -41.26 41.9 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.989 0.423 . . . . 0.0 111.264 179.724 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.6 pt-20 -61.25 -50.93 71.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.488 -179.566 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.761 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -71.65 -40.57 69.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.403 -179.347 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.648 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -62.25 -32.42 73.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.8 m -82.19 -31.13 30.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.569 179.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 1.2 pp0? -67.23 -44.75 78.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.011 -179.64 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.624 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.8 mt -74.71 -46.19 39.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.429 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -77.66 51.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.476 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.18 -26.99 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.88 -179.326 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.653 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.2 m-85 -61.03 119.43 8.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.413 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.448 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 0.1 OUTLIER -44.89 -46.75 11.06 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.078 0.466 . . . . 0.0 111.87 -179.02 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.96 ' HB3' HD13 ' A' ' 85' ' ' LEU . 13.1 mp0 -52.46 -54.49 31.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.827 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.77 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.61 -41.37 98.94 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -178.595 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -55.77 -34.49 65.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.685 0.278 . . . . 0.0 110.344 179.729 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.79 -43.75 53.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.471 179.544 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.826 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.41 -45.54 80.62 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.302 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.648 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.5 OUTLIER -75.58 -26.41 57.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.991 178.138 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.514 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.4 -52.06 37.15 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.31 0.576 . . . . 0.0 110.533 179.867 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.674 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 4.5 mm-40 -69.9 -28.99 66.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.861 -179.594 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -58.29 -47.98 86.33 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.313 179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.491 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.9 OUTLIER -75.21 -33.08 61.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.984 0.421 . . . . 0.0 110.342 179.587 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . 0.423 ' OE1' ' HA ' ' A' ' 145' ' ' GLN . 4.4 tp60 -63.31 -51.88 64.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.716 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -61.93 -50.48 71.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.739 179.815 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.481 ' HG ' HD13 ' A' ' 100' ' ' LEU . 69.9 mt -59.48 -34.11 72.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.1 t -74.02 -20.02 60.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.724 179.36 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.53 0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.937 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.668 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 121.381 0.61 . . . . 0.0 111.49 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.075 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.39 138.87 45.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.52 179.801 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.8 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.1 OUTLIER -79.11 128.52 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.984 -179.981 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.82 161.07 39.6 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 20.8 m -157.14 123.47 4.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.162 0.506 . . . . 0.0 111.212 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.534 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.49 170.85 13.66 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.483 178.79 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.467 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -122.73 118.15 27.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.049 0.425 . . . . 0.0 111.669 -179.42 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.778 HD11 ' HB1' ' A' ' 139' ' ' ALA . 56.1 mt -83.01 91.22 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.432 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.128 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.004 HD11 HG23 ' A' ' 64' ' ' THR . 29.6 mt -81.15 145.29 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.049 -178.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.713 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 46.2 p90 -151.91 121.19 6.77 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.016 -178.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.469 ' CD ' ' HA ' ' A' ' 106' ' ' TYR . 8.9 ttp180 -76.67 118.02 18.88 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.3 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.617 HH11 ' HB2' ' A' ' 18' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.946 -178.378 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.772 0.32 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.713 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.3 mt -107.61 154.9 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.114 0.483 . . . . 0.0 111.772 -179.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.612 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.5 mp0 -138.37 127.32 23.94 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.121 179.659 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.649 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 55.2 m-85 -91.35 146.68 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.955 0.407 . . . . 0.0 112.036 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.646 HD23 HD12 ' A' ' 15' ' ' ILE . 43.5 tp -81.88 132.68 35.28 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.652 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.499 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.5 mt -133.14 142.74 48.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.968 0.413 . . . . 0.0 110.791 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 112' ' ' LEU . 17.2 mt -121.81 104.2 9.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.535 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 3.8 tt0 -64.56 134.07 53.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.271 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.366 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.599 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . 0.441 ' HB2' ' HE1' ' A' ' 133' ' ' PHE . 3.8 p-80 . . . . . 0 N--CA 1.455 -0.197 0 CA-C-O 120.911 0.386 . . . . 0.0 111.211 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.595 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.6 m95 -104.59 137.9 41.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.296 -179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.7 OUTLIER -160.5 136.68 6.23 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.985 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.02 178.78 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.405 2.07 . . . . 0.0 111.656 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HG3' HD11 ' A' ' 34' ' ' LEU . 50.9 Cg_exo -56.31 98.12 0.07 OUTLIER 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.437 2.091 . . . . 0.0 112.644 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -97.97 129.31 44.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.773 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -146.47 140.74 8.97 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.701 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 5.8 p80 -76.29 127.23 32.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.663 0.268 . . . . 0.0 110.798 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.8 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -88.72 137.32 21.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.984 0.421 . . . . 0.0 110.582 179.634 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.666 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 3.0 tt0 -89.72 152.12 46.48 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.4 Cg_endo -55.25 -22.91 34.7 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.524 2.149 . . . . 0.0 112.971 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.666 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.42 -11.83 43.57 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.383 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -88.05 158.64 18.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.603 0.24 . . . . 0.0 110.63 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.915 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 16.8 t0 -77.73 163.42 26.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.995 0.426 . . . . 0.0 110.22 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.87 -61.37 1.79 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.649 HD21 HG21 ' A' ' 77' ' ' ILE . 22.0 tp -64.32 -41.7 96.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.145 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.915 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 2.1 mt-10 -51.19 -45.15 61.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.687 -179.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.584 HG21 ' HB ' ' A' ' 50' ' ' VAL . 82.4 m -58.21 -40.91 82.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.149 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -72.49 -30.62 64.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.905 178.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.0 mt -72.62 -52.47 15.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.421 179.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.48 -41.02 96.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.804 -179.659 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 46' ' ' PRO . . . -60.45 -33.64 72.86 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.147 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 1.004 HG23 HD11 ' A' ' 15' ' ' ILE . 24.5 m -60.14 -58.26 9.28 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.412 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.484 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -70.18 -20.31 63.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.621 179.47 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.4 tm-20 -79.06 -39.86 32.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.125 179.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.414 ' O ' ' CD2' ' A' ' 112' ' ' LEU . 10.3 mm-40 -106.38 -5.3 19.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.934 -179.309 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.46 -11.76 1.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.525 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.687 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.38 -3.85 51.9 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.857 -1.164 . . . . 0.0 112.85 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.789 HD11 ' CD1' ' A' ' 110' ' ' ILE . 5.0 mt -99.01 121.79 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.53 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 pm0 -105.11 171.06 7.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.523 0.202 . . . . 0.0 111.208 -179.387 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.93 -31.7 7.78 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.698 179.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.89 -23.85 75.46 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.317 -0.944 . . . . 0.0 111.857 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.548 ' HB3' HG23 ' A' ' 70' ' ' ILE . 2.5 tp60 -95.03 3.85 54.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 0.0 110.921 179.655 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.897 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.48 -169.25 2.83 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.289 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -137.23 100.3 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.364 -179.671 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.649 HG21 HD21 ' A' ' 57' ' ' LEU . 10.1 mm -71.59 126.92 32.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.96 179.74 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.535 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -90.02 137.69 20.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.062 0.458 . . . . 0.0 111.07 -179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -97.85 149.95 21.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.397 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.21 -27.1 21.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.352 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.896 ' CD1' HD21 ' A' ' 100' ' ' LEU . 15.0 t80 -105.03 126.02 51.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.733 0.301 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.57 124.56 5.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.257 0.551 . . . . 0.0 111.524 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.76 140.71 21.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.464 179.053 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.959 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.0 pm0 -121.19 138.26 54.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.05 0.452 . . . . 0.0 111.771 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.797 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -98.87 116.91 32.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.622 179.457 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.1 p30 -113.86 125.66 54.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.5 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 10.1 p90 -166.67 146.25 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.572 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.9 p -82.37 110.71 17.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.332 179.561 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -80.78 -95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.627 -179.066 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.472 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -67.28 -41.17 85.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.872 0.368 . . . . 0.0 110.655 -179.923 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.499 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER 178.12 26.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.278 179.766 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.81 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.48 129.94 4.24 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.447 179.591 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.911 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.5 Cg_endo -70.07 119.58 6.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.208 2.605 . . . . 0.0 112.998 -179.195 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 1.075 ' HG2' HD13 ' A' ' 8' ' ' LEU . 7.4 mmmt -104.3 121.9 44.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.047 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.457 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.0 m -87.94 116.81 26.37 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.619 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.1 t -115.81 108.9 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.859 -178.114 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.959 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.6 mm -86.0 126.63 40.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.374 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.636 ' HB3' HG13 ' A' ' 14' ' ' ILE . 13.8 m-85 -113.27 133.25 55.2 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.085 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.636 ' CD2' HD13 ' A' ' 57' ' ' LEU . 9.3 m-90 -117.83 141.43 48.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.949 178.566 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.896 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -78.07 115.65 17.96 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.791 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.601 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -124.55 144.4 50.15 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.16 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.458 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.3 tt0 -123.1 116.38 23.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.81 0.338 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.733 HG12 HD23 ' A' ' 75' ' ' LEU . 11.2 m -73.22 115.01 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.431 0.634 . . . . 0.0 110.705 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.532 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.17 -11.95 17.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.607 -179.188 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.812 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 66.9 t0 -114.12 121.55 44.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.619 179.278 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.469 ' HA ' ' CD ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -70.59 -47.47 60.01 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.581 0.705 . . . . 0.0 109.456 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -85.03 16.49 3.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.057 178.491 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.812 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.8 p -46.14 144.53 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.153 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.101 179.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.6 OUTLIER -66.82 143.95 56.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 111.755 -179.033 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.866 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.0 mm -123.45 99.8 7.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.81 -1.087 . . . . 0.0 110.222 179.37 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.687 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 23.8 mtp180 -102.13 103.08 13.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.332 -178.658 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 34' ' ' LEU . 11.3 mt -98.85 135.6 40.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -164.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.113 179.343 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 14.4 0.92 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 179.681 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.62 -36.15 7.58 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.843 0.354 . . . . 0.0 110.886 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.407 ' CD2' ' HB3' ' A' ' 67' ' ' GLU . 75.3 m-70 -113.31 115.68 28.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.607 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -86.93 -14.36 42.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.827 -179.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -160.05 153.11 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.07 0.462 . . . . 0.0 112.131 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.866 ' CD1' HG21 ' A' ' 110' ' ' ILE . 45.0 p90 -133.19 171.41 14.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.168 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.42 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 3.6 mtt180 -157.37 160.3 38.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.213 0.53 . . . . 0.0 111.846 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.2 m95 -124.21 107.67 11.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.791 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.47 168.49 19.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.942 -178.303 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.73 -153.94 2.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.998 179.59 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 141' ' ' GLN . 12.4 tp -77.33 -41.6 39.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.828 0.347 . . . . 0.0 111.119 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.6 pt-20 -61.43 -50.23 73.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.619 -179.449 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.833 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.93 -45.8 63.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.87 0.366 . . . . 0.0 110.531 -179.47 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.499 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -56.89 -30.46 63.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 109.802 179.174 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.7 m -84.38 -31.98 24.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.271 178.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.833 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.01 -43.79 91.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.872 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.647 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.1 mt -77.72 -42.55 33.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.954 179.281 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.2 53.5 1.24 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.14 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 114.885 -1.052 . . . . 0.0 111.876 -178.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.5 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 40.9 m-85 -59.74 120.75 10.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.308 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -46.32 -52.27 13.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.301 0.572 . . . . 0.0 111.26 -179.453 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.797 ' HB3' HD13 ' A' ' 85' ' ' LEU . 15.9 mp0 -43.6 -54.39 4.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.829 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.667 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -66.39 -34.06 77.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.872 0.368 . . . . 0.0 110.584 -179.498 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.91 -35.32 74.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.408 179.545 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.42 -45.29 22.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.794 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.778 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.84 -55.38 23.48 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.114 179.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.667 HD12 ' O ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -63.8 -27.56 69.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.455 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.529 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.99 -51.77 35.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.029 -179.9 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.588 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 71.1 mm-40 -71.26 -30.96 66.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.32 -47.63 88.45 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.651 179.105 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.506 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 29.8 t-80 -74.58 -31.69 62.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.803 0.335 . . . . 0.0 110.435 179.192 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -64.68 -53.2 51.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.348 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.16 -48.9 78.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.747 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.614 HD11 ' HB3' ' A' ' 100' ' ' LEU . 79.3 mt -60.91 -26.99 67.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.532 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.7 t -76.04 -17.13 59.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.782 0.325 . . . . 0.0 110.792 179.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.333 -0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.598 -179.766 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 N--CA 1.461 0.124 0 CA-C-O 121.062 0.458 . . . . 0.0 111.351 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.801 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -118.22 137.19 53.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.309 179.565 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.867 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.65 115.74 24.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.146 -179.665 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -126.84 174.59 8.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.679 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -164.04 124.91 2.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.164 0.507 . . . . 0.0 111.186 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.672 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.94 175.88 15.9 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.789 HD11 HD23 ' A' ' 61' ' ' LEU . 1.2 mt -128.99 119.4 24.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.466 0.633 . . . . 0.0 112.693 -178.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.572 HD11 ' HB3' ' A' ' 98' ' ' TYR . 14.2 mm -77.0 91.61 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.225 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.987 HD11 HG23 ' A' ' 64' ' ' THR . 58.7 mt -88.01 141.83 13.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.601 -178.287 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.814 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 54.8 p90 -152.23 122.42 7.16 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -179.116 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 9.2 ptt85 -83.69 114.31 21.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.251 179.31 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.95 -179.546 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 121.028 0.442 . . . . 0.0 111.668 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.824 ' HB ' ' HE2' ' A' ' 144' ' ' HIS . 4.1 mt -106.29 143.54 17.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.113 -179.05 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.751 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.6 OUTLIER -137.28 132.94 34.43 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.244 179.45 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.66 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 45.0 m-85 -94.75 143.52 26.38 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.072 0.463 . . . . 0.0 112.233 -178.682 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.652 HD21 ' CB ' ' A' ' 68' ' ' ALA . 50.0 tp -79.59 132.87 36.39 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.339 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.572 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.7 mt -135.04 140.71 45.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.648 179.833 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 112' ' ' LEU . 8.7 mt -117.86 123.79 46.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 -178.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.495 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 1.2 tt0 -68.59 151.71 46.36 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.135 -179.414 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.16 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.344 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 120.815 0.341 . . . . 0.0 110.884 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.507 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 26.8 m95 -103.05 110.31 22.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.386 179.733 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.644 ' HB ' ' HE2' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -126.91 128.47 24.21 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.778 -179.323 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.573 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 49.2 Cg_exo -55.9 168.18 1.93 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.326 2.017 . . . . 0.0 112.493 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.65 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 15.2 Cg_endo -59.79 101.04 0.14 Allowed 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 123.148 2.565 . . . . 0.0 112.875 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE2' ' HB ' ' A' ' 44' ' ' THR . 4.7 mtmt -103.52 129.57 50.73 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.852 0.358 . . . . 0.0 111.093 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.55 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.13 -179.37 20.25 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.345 179.744 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -120.02 104.84 10.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 110.69 179.692 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.867 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -76.2 129.04 37.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.042 0.449 . . . . 0.0 111.193 -179.138 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.667 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -92.4 177.01 2.28 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.539 -179.596 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.667 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.0 Cg_exo -57.42 -60.25 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.684 2.256 . . . . 0.0 112.72 -178.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.54 0.13 88.41 Favored Glycine 0 CA--C 1.517 0.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.694 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.606 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 17.6 tt0 -78.73 171.98 14.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.35 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.4 t70 -98.6 158.69 15.44 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.208 0.527 . . . . 0.0 110.056 178.896 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.556 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.755 -179.074 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' CD2' ' A' ' 99' ' ' TRP . 33.1 tp -65.2 -39.04 92.3 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.668 0.27 . . . . 0.0 111.223 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.998 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -49.1 -45.38 43.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.665 179.675 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.551 HG21 ' N ' ' A' ' 50' ' ' VAL . 66.6 m -59.83 -48.62 80.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.33 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -64.64 -28.02 69.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.158 178.694 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.2 mt -76.35 -51.67 11.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.25 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -63.08 -35.18 79.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.55 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.72 -38.23 88.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.987 HG23 HD11 ' A' ' 15' ' ' ILE . 56.2 m -56.15 -51.21 68.8 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.593 179.133 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.471 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.2 pt20 -76.03 -21.97 56.26 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.961 179.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 0.9 OUTLIER -75.9 -35.89 59.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.214 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.65 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 2.8 mm-40 -112.04 -4.99 14.33 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.652 ' CB ' HD21 ' A' ' 32' ' ' LEU . . . -136.92 -6.65 1.87 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 179.697 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.548 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 72.94 -7.73 9.11 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.219 -0.991 . . . . 0.0 113.804 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.737 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.0 OUTLIER -96.6 129.14 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.005 0.431 . . . . 0.0 111.161 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.9 pt-20 -110.63 170.2 8.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 -179.682 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.13 -36.3 5.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.156 179.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.87 -24.04 74.27 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.53 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.493 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.8 mm100 -97.1 -4.04 40.14 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.676 -0.308 . . . . 0.0 111.485 -179.673 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.59 -170.93 2.48 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.898 0.38 . . . . 0.0 110.257 178.128 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.569 ' H ' ' H ' ' A' ' 102' ' ' GLU . 34.6 m -133.65 100.06 4.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.605 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.603 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 12.2 mm -72.26 113.11 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.732 -179.608 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.766 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.2 mp -73.49 144.95 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.845 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -100.17 148.96 24.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.205 -179.65 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.1 -17.44 57.09 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.714 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.512 ' CD2' HD11 ' A' ' 100' ' ' LEU . 30.5 t80 -100.3 102.45 13.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -126.02 135.59 51.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.004 0.431 . . . . 0.0 110.42 179.366 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -163.56 145.93 9.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.574 179.962 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.924 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -136.15 116.43 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.983 0.421 . . . . 0.0 111.908 179.88 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.92 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.9 mt -77.73 119.17 20.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.956 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -112.82 119.98 39.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.862 -179.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.552 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 7.8 p90 -167.28 144.34 4.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.258 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.628 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.2 p -81.84 115.38 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.416 0.627 . . . . 0.0 110.387 179.156 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -72.72 -98.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.938 -178.309 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB2' HH11 ' A' ' 90' ' ' ARG . 0.0 OUTLIER -78.39 -35.55 47.09 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.099 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.564 ' O ' ' HE2' ' A' ' 92' ' ' LYS . 1.1 m-20 -174.6 18.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.359 179.616 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.801 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -150.77 128.39 5.67 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-O 120.992 0.425 . . . . 0.0 110.883 -179.94 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.735 ' O ' HD12 ' A' ' 8' ' ' LEU . 60.3 Cg_endo -74.09 118.32 5.35 Favored 'Trans proline' 0 CA--C 1.509 -0.768 0 C-N-CA 123.397 2.732 . . . . 0.0 112.973 -179.293 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.5 ttpt -101.53 121.82 42.68 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.168 -179.373 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.1 m -86.69 108.06 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 178.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.71 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 30.0 t -105.92 108.19 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.706 -178.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.924 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.92 124.75 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.31 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.572 ' HB3' HD11 ' A' ' 14' ' ' ILE . 35.9 m-85 -110.72 130.83 55.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.847 -178.203 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CD2' HD13 ' A' ' 57' ' ' LEU . 6.3 m-90 -116.49 150.54 37.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.783 178.43 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 26.2 mt -78.89 132.88 36.94 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -139.98 140.96 36.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.994 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.569 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.4 tt0 -123.91 113.43 18.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.751 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.831 HG12 HD23 ' A' ' 75' ' ' LEU . 17.1 m -72.21 110.23 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 121.416 0.627 . . . . 0.0 110.396 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -58.56 -13.48 5.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.918 -179.038 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 65.0 t0 -108.26 114.76 28.88 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.025 0.441 . . . . 0.0 111.526 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . 0.42 ' CE1' ' CD ' ' A' ' 17' ' ' ARG . 0.5 OUTLIER -61.91 -42.54 99.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.121 179.357 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -96.58 25.23 5.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.103 179.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.7 p -49.33 147.28 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.347 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.444 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.7 pm0 -72.43 142.73 48.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.321 0.581 . . . . 0.0 110.822 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.858 HG21 ' CG ' ' A' ' 119' ' ' TYR . 44.4 mm -121.48 98.69 6.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.548 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.99 101.89 13.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.531 -179.169 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 34' ' ' LEU . 4.5 mt -92.07 160.81 15.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.016 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.21 -170.82 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.649 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -66.34 -34.67 78.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.324 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.19 -6.4 49.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.591 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.582 ' CB ' ' HB3' ' A' ' 112' ' ' LEU . 3.1 m-70 -110.93 127.86 55.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 111.131 -179.671 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.454 ' CG ' ' HG2' ' A' ' 35' ' ' GLN . 1.4 pp0? -99.41 -23.2 15.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.068 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.4 -177.57 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 111.956 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.858 ' CG ' HG21 ' A' ' 110' ' ' ILE . 40.7 p90 -147.44 169.51 19.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.186 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 96.5 mtt180 -153.89 154.72 34.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.236 0.541 . . . . 0.0 111.63 -179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -119.31 107.06 12.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.468 178.698 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.72 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.28 169.31 18.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.102 0.477 . . . . 0.0 111.632 -178.144 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.42 -154.05 1.58 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.731 179.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.0 tp -76.79 -42.55 40.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.864 0.364 . . . . 0.0 111.359 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.8 pt-20 -63.08 -47.16 84.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.819 -179.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.732 ' O ' HD12 ' A' ' 130' ' ' LEU . 0.3 OUTLIER -74.54 -38.83 62.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.941 0.401 . . . . 0.0 110.544 -179.741 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.689 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -64.29 -29.52 70.61 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.496 0.665 . . . . 0.0 109.209 178.465 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.426 ' SG ' ' HG3' ' A' ' 137' ' ' LYS . 43.9 m -84.01 -36.35 23.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.611 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.8 OUTLIER -59.35 -44.79 92.63 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.742 -179.95 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -75.85 -39.69 56.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.701 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.494 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.9 52.59 1.26 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.176 178.082 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . 0.414 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.92 -31.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.59 -178.815 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.72 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 25.5 m-85 -63.18 121.29 13.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.705 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 137' ' ' LYS . 9.3 tttt -46.48 -54.31 9.5 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.158 0.504 . . . . 0.0 111.853 -179.494 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.92 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.0 mp0 -41.29 -54.92 2.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.1 -179.24 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.682 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.23 -30.92 71.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.331 . . . . 0.0 110.613 179.875 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -58.07 -36.58 73.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -76.99 -46.95 22.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.215 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -50.81 -50.82 55.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.074 0.464 . . . . 0.0 110.209 179.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.689 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.8 OUTLIER -72.15 -32.01 66.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.994 178.798 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.74 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -59.06 -51.99 67.66 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.893 -179.753 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' HE2' ' A' ' 81' ' ' PHE . 1.5 mt-10 -69.57 -27.6 65.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.366 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.91 -48.62 65.92 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.916 179.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . 0.824 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.6 OUTLIER -80.7 -32.72 35.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.078 0.466 . . . . 0.0 110.325 179.551 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 11.6 tp-100 -65.96 -52.62 48.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.972 -179.636 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -61.63 -53.48 55.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.622 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' A' ' 16' ' ' PHE . 92.8 mt -57.61 -29.94 64.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.463 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -24.46 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.546 179.549 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.24 -179.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . . . . . . 0 CA--C 1.516 -0.347 0 CA-C-O 121.363 0.602 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.048 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.6 131.58 54.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.282 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.757 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtm180 -81.89 128.35 33.95 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.836 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.32 156.27 44.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.852 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.556 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 56.9 m -149.3 124.06 9.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.002 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.66 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.44 168.91 13.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.672 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.79 HD11 HD23 ' A' ' 61' ' ' LEU . 1.5 mt -118.99 117.68 29.44 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.833 -179.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.978 HD11 ' HB1' ' A' ' 139' ' ' ALA . 38.7 mt -82.18 92.37 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 27.7 mt -86.39 145.57 7.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.783 -177.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.832 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.3 p90 -150.83 123.67 8.64 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -178.967 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.545 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -82.1 112.53 19.23 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HD3' HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--N 1.326 -0.419 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.046 -179.858 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.826 0.346 . . . . 0.0 111.642 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ILE . . . . . 0.832 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.9 mt -98.64 147.26 7.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.205 0.526 . . . . 0.0 112.143 -178.839 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.654 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.9 mt-10 -138.92 124.68 19.7 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.776 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.693 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.1 m-85 -88.76 147.1 24.64 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.657 HD13 ' CE2' ' A' ' 121' ' ' TRP . 45.5 tp -85.87 132.62 34.06 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.843 178.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.51 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 4.4 mt -133.03 144.55 50.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.878 0.37 . . . . 0.0 110.757 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.677 HD11 ' HG3' ' A' ' 46' ' ' PRO . 63.4 mt -123.31 106.71 10.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.052 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -60.02 139.05 57.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.504 179.347 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 . . . . . 0 CA--C 1.519 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.654 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 54.9 m95 -100.05 157.94 16.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.093 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.6 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -173.19 130.62 0.57 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.221 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 75.0 Cg_exo -50.99 169.12 0.19 Allowed 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.025 1.817 . . . . 0.0 112.091 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' PRO . . . . . 0.864 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 16.5 Cg_exo -64.25 81.14 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.492 2.128 . . . . 0.0 111.847 179.606 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -104.55 151.92 23.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.133 -179.786 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.536 ' O ' ' HB1' ' A' ' 10' ' ' ALA . . . -134.65 -172.69 12.87 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.592 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 p80 -109.74 110.82 21.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.713 0.292 . . . . 0.0 110.456 179.636 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.757 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.8 p -79.71 132.97 30.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.507 0.67 . . . . 0.0 111.135 -179.083 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.773 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.9 tt0 -91.03 152.79 44.6 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.516 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 19.6 Cg_endo -57.17 -15.86 19.65 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.647 2.231 . . . . 0.0 112.525 -179.292 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.773 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -106.23 -11.44 27.63 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 178.982 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -87.83 170.92 10.77 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . 0.977 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -87.52 162.08 17.42 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . 0.513 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 9.6 m-20 -73.91 -63.5 1.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.864 -179.368 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.588 HD21 HG21 ' A' ' 77' ' ' ILE . 23.3 tp -64.63 -39.06 93.03 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.685 0.279 . . . . 0.0 110.639 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.977 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.76 -45.71 59.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.653 179.277 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.556 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 92.4 m -59.5 -43.46 93.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.199 0.523 . . . . 0.0 109.655 179.513 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.554 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.39 -29.73 65.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.194 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.819 HD22 ' HB2' ' A' ' 72' ' ' ALA . 94.1 mt -74.9 -52.97 9.9 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.038 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.13 -38.08 85.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.641 -179.849 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.8 76.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.025 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 40.9 m -62.58 -54.71 35.59 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.572 179.44 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.47 -25.03 61.28 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.697 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 3.2 mm-40 -78.06 -33.55 50.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.076 179.53 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HB3' HD13 ' A' ' 34' ' ' LEU . 57.3 mt-10 -112.9 6.94 18.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.959 -179.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.628 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.01 -7.21 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.604 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 72.62 -3.24 26.91 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.461 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.663 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -101.02 120.69 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-O 121.154 0.502 . . . . 0.0 110.97 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.1 pt-20 -106.15 170.69 7.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.198 -179.217 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.868 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.56 -33.03 13.86 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.124 0.488 . . . . 0.0 110.251 179.064 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.507 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -70.66 -11.46 68.95 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.479 179.837 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.599 HE21 ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -113.7 -13.47 12.68 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.822 0.311 . . . . 0.0 111.053 179.286 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.868 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -120.32 -173.13 2.5 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.805 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.576 ' H ' ' H ' ' A' ' 102' ' ' GLU . 33.8 m -131.62 98.12 4.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.384 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.735 HD12 HD21 ' A' ' 13' ' ' LEU . 14.8 mm -70.64 102.17 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.361 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.616 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -65.3 140.02 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 110.437 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -97.83 150.97 20.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.555 -179.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.13 -21.85 38.49 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.651 179.634 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.55 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.3 t80 -108.93 126.17 52.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.816 0.341 . . . . 0.0 111.368 -179.59 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.687 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.8 134.29 8.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.188 179.51 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -157.78 145.66 18.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.873 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -123.48 136.18 54.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 179.561 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.904 HD13 ' CB ' ' A' ' 135' ' ' GLU . 10.8 mt -100.01 119.09 37.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.097 179.761 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.7 118.64 37.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.466 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.536 ' CD2' ' HG2' ' A' ' 135' ' ' GLU . 17.1 p90 -167.22 147.41 5.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.012 179.748 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.636 HG23 ' C ' ' A' ' 92' ' ' LYS . 9.9 p -83.81 112.88 21.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 179.232 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -79.85 -100.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.761 -178.494 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -45.84 88.99 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.143 0.497 . . . . 0.0 110.241 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.523 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 1.1 t30 -174.74 21.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.218 179.531 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 1.048 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.8 tptt -151.25 130.91 6.73 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.868 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.2 Cg_endo -67.74 118.61 5.73 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.388 2.725 . . . . 0.0 112.554 -179.436 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 1.016 ' HG2' HD13 ' A' ' 8' ' ' LEU . 8.5 mtpp -106.15 123.37 47.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.65 -178.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.8 m -89.21 105.75 17.99 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.718 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 20.3 t -105.7 108.19 24.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.873 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -87.41 126.55 41.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 178.062 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' TYR . . . . . 0.784 ' HB3' HG13 ' A' ' 14' ' ' ILE . 39.1 m-85 -114.9 128.88 56.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.109 0.481 . . . . 0.0 111.76 -178.775 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' TRP . . . . . 0.687 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -113.29 147.24 37.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.106 179.198 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.616 HD12 HG21 ' A' ' 78' ' ' ILE . 12.9 mt -78.37 132.93 37.58 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' ALA . . . . . 0.647 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -142.71 144.57 32.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.908 0.385 . . . . 0.0 111.286 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.576 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.3 tm-20 -124.6 114.7 19.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.491 179.153 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.76 HG12 HD23 ' A' ' 75' ' ' LEU . 5.1 m -71.85 123.7 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-O 121.376 0.607 . . . . 0.0 110.065 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 1.4 mttm -60.13 -28.58 68.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.29 -177.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' ASP . . . . . 0.718 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.3 t0 -102.11 121.35 42.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 0.0 111.722 -178.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -43.63 94.28 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.81 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -99.66 25.9 6.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.703 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.718 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.8 p -42.99 151.39 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.332 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 6.3 pm0 -69.95 141.85 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.174 0.511 . . . . 0.0 111.233 -179.209 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.851 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.3 mm -120.34 98.01 5.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.808 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' ARG . . . . . 0.604 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 3.3 mtp180 -98.32 97.51 8.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.554 -179.128 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.641 HD22 HD22 ' A' ' 34' ' ' LEU . 10.2 mt -92.66 125.51 37.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 115' ' ' GLU . 54.5 m -82.8 -166.38 1.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.357 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -75.7 19.47 0.2 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.64 0.257 . . . . 0.0 111.329 179.784 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 115' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 113' ' ' SER . 50.7 mt-10 -105.26 -34.11 7.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.788 0.327 . . . . 0.0 110.626 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 11.0 m80 -118.1 137.32 53.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.1 tp-100 -85.27 -27.29 26.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.842 -179.437 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.0 174.35 6.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 111.583 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.851 ' CD1' HG21 ' A' ' 110' ' ' ILE . 23.6 p90 -136.97 174.01 11.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.509 -179.266 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HG3' ' CH2' ' A' ' 43' ' ' TRP . 1.7 mtt-85 -157.94 162.38 38.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.215 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' TRP . . . . . 0.657 ' CE2' HD13 ' A' ' 32' ' ' LEU . 91.0 m95 -131.0 107.16 8.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.861 179.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.89 172.36 12.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.012 0.434 . . . . 0.0 111.42 -178.838 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.81 -151.7 5.95 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.732 -0.746 . . . . 0.0 111.665 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 141' ' ' GLN . 5.5 tp -77.53 -39.74 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.797 0.332 . . . . 0.0 111.187 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -63.03 -50.62 69.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.797 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . 0.825 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -71.39 -46.9 59.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.111 -179.564 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.11 -27.55 54.29 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.225 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 128' ' ' CYS . . . . . 0.498 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -82.5 -31.77 29.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.647 178.58 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . 0.726 HE21 ' HG ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -65.99 -45.24 82.34 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.096 -179.676 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.726 ' HG ' HE21 ' A' ' 129' ' ' GLN . 0.5 OUTLIER -78.47 -40.01 36.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.359 179.239 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.55 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -73.72 49.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.771 179.583 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.82 -31.23 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.151 -179.182 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -61.6 118.75 7.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.83 0.348 . . . . 0.0 110.7 179.959 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -46.24 -38.11 8.06 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.904 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.8 mp0 -59.65 -56.98 15.08 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.273 -179.391 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 136' ' ' MET . . . . . 0.6 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -54.33 -45.13 72.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.028 -179.406 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 137' ' ' LYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.06 -35.3 46.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.591 179.672 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.47 -46.51 22.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.681 179.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 139' ' ' ALA . . . . . 0.978 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.11 -48.36 67.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.442 179.425 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -74.48 -25.98 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.092 178.854 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.46 -51.83 52.65 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.09 179.942 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 142' ' ' GLU . . . . . 0.499 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 10.0 mm-40 -69.93 -28.74 65.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.513 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.8 93.01 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.04 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -76.11 -28.84 57.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.342 179.394 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -70.6 -50.1 40.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.091 -179.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -67.8 -52.08 41.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.149 -179.667 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.461 ' CD2' HG12 ' A' ' 78' ' ' ILE . 96.1 mt -57.27 -27.71 62.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.529 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.53 -21.73 66.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.683 179.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.53 0.197 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.895 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.507 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -72.39 92.06 0.76 Allowed 'Trans proline' 0 N--CA 1.447 -1.243 0 C-N-CA 124.329 3.353 . . . . 0.0 109.617 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.59 149.05 40.36 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.793 0.33 . . . . 0.0 111.022 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.36 -15.06 0.9 Allowed Glycine 0 CA--C 1.522 0.49 0 C-N-CA 120.647 -0.787 . . . . 0.0 113.347 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.2 p -85.7 111.76 20.41 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.937 0.369 . . . . 0.0 111.05 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.465 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 11.3 tpt -87.6 124.43 33.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.964 179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 71.1 167.41 0.31 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.214 0.53 . . . . 0.0 111.399 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -106.53 139.2 41.36 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.788 -179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.627 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.37 125.37 33.61 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.13 -179.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.565 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -136.09 167.01 22.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.744 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.502 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -157.83 123.89 4.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.079 0.466 . . . . 0.0 111.18 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.534 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.7 169.72 13.14 Favored Glycine 0 N--CA 1.451 -0.331 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.035 179.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.748 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -124.64 117.75 24.97 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.63 0.252 . . . . 0.0 111.596 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.031 HD11 ' HB1' ' A' ' 139' ' ' ALA . 23.7 mt -85.95 91.99 3.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.957 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.46 146.02 7.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.874 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.608 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 45.8 p90 -150.04 125.2 10.04 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.701 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.77 113.53 24.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.798 0.332 . . . . 0.0 110.343 178.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 18' ' ' ARG . 12.6 ttp180 -89.54 117.56 28.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.26 -179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -73.36 160.28 32.04 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.744 179.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.439 ' HG ' HG23 ' A' ' 21' ' ' ILE . 35.0 tp -55.24 -82.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.375 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.439 HG23 ' HG ' ' A' ' 20' ' ' LEU . 2.8 pp -110.86 156.13 41.24 Favored Pre-proline 0 C--N 1.333 -0.137 0 CA-C-O 120.738 0.304 . . . . 0.0 111.376 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -65.83 157.53 58.52 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.694 2.262 . . . . 0.0 112.16 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.417 ' HE2' ' CD1' ' A' ' 21' ' ' ILE . 3.5 mmtt -106.43 -78.33 0.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.907 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.622 ' O ' HG12 ' A' ' 24' ' ' VAL . 20.9 t -93.19 12.55 2.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.436 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 65.69 14.91 9.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.281 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -111.57 -75.06 0.62 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.951 0.405 . . . . 0.0 110.559 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.43 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 12.6 m120 -88.66 175.99 7.3 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.506 179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.43 ' HB2' ' O ' ' A' ' 27' ' ' ASN . . . 177.19 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.92 0.391 . . . . 0.0 111.184 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.5 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -105.76 148.03 10.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.329 0.585 . . . . 0.0 111.847 -179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.608 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 8.4 mt-10 -122.34 173.78 7.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.863 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 34.0 m-85 -138.55 133.56 32.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.63 0.252 . . . . 0.0 111.35 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.643 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.2 tp -76.8 133.21 39.46 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.584 HD22 ' HB3' ' A' ' 43' ' ' TRP . 5.4 mt -132.98 144.53 50.18 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.98 0.419 . . . . 0.0 111.019 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 112' ' ' LEU . 54.3 mt -123.13 116.54 23.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.989 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 7.5 tt0 -74.55 132.35 41.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.184 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -56.64 151.09 14.46 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.04 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 2.2 p -82.77 1.4 39.09 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.426 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -171.0 -175.3 1.7 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.726 0.298 . . . . 0.0 110.926 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 74.9 -130.45 11.59 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.515 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.507 ' O ' HG12 ' A' ' 40' ' ' ILE . 14.8 tt -83.94 -1.53 6.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.806 0.336 . . . . 0.0 111.312 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 60.13 34.7 21.19 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.016 0.436 . . . . 0.0 110.468 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.43 ' CE1' " H2'" ' A' ' 154' ' ' ATP . 7.9 p-80 -65.14 158.36 26.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.788 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.584 ' HB3' HD22 ' A' ' 33' ' ' LEU . 72.6 m95 -108.27 123.09 48.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.094 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 64.4 p -147.11 151.28 40.72 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.741 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.504 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 41.7 Cg_endo -66.79 168.3 17.25 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.493 2.128 . . . . 0.0 111.86 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.556 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 36.1 Cg_exo -60.3 99.53 0.14 Allowed 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.588 2.192 . . . . 0.0 112.775 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 4.4 pttt -106.83 140.1 40.19 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.683 179.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.36 178.42 16.76 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.628 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -103.71 94.22 5.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.791 0.329 . . . . 0.0 110.666 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.675 ' N ' HG21 ' A' ' 59' ' ' THR . 1.7 p -69.56 132.13 33.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.068 0.461 . . . . 0.0 111.031 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.539 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.3 tt0 -95.35 151.88 38.96 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.119 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.539 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.3 Cg_endo -49.38 -33.08 28.18 Favored 'Trans proline' 0 N--CA 1.464 -0.249 0 C-N-CA 122.682 2.255 . . . . 0.0 112.585 -179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.521 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -90.4 -13.38 60.08 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.345 179.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -87.67 165.12 15.63 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.553 0.216 . . . . 0.0 110.528 179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.899 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 33.8 t70 -82.79 161.34 22.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.078 0.466 . . . . 0.0 110.711 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.5 -63.62 1.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.689 HD21 HG21 ' A' ' 77' ' ' ILE . 15.5 tp -61.87 -40.12 94.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.491 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.899 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -50.81 -50.06 57.14 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.555 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.675 HG21 ' N ' ' A' ' 50' ' ' VAL . 86.7 m -54.88 -36.81 65.53 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.502 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -75.22 -32.09 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.043 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.827 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -72.03 -53.03 14.17 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.641 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 8.5 ttt-85 -59.02 -43.61 91.59 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.416 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.61 70.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.279 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.957 HG23 HD11 ' A' ' 15' ' ' ILE . 27.2 m -62.93 -53.78 48.82 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.328 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.499 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.4 pt20 -74.17 -23.05 59.18 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.726 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -79.47 -37.46 36.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -110.07 9.84 24.1 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.81 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.714 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -153.25 -14.55 0.15 Allowed 'General case' 0 N--CA 1.463 0.182 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.536 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 80.2 -6.41 60.15 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.578 HG21 HD23 ' A' ' 75' ' ' LEU . 2.6 mt -98.03 127.41 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 CA-C-O 120.924 0.392 . . . . 0.0 110.949 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.8 pt-20 -107.5 170.3 8.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.867 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.62 -31.34 10.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.995 0.426 . . . . 0.0 110.9 179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.46 -21.03 79.66 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.184 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -97.38 -5.6 35.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.648 0.261 . . . . 0.0 111.069 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.867 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.03 -167.82 1.9 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.781 0.324 . . . . 0.0 110.292 179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 55.2 m -140.02 97.48 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.897 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.689 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -70.77 112.83 6.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.018 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.97 134.6 29.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 -179.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -94.26 151.28 19.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.36 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 101.81 -21.98 40.14 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.524 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.819 ' CE1' HD21 ' A' ' 100' ' ' LEU . 18.9 t80 -106.29 126.55 52.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.798 0.333 . . . . 0.0 110.869 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.49 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.75 125.97 5.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.083 0.468 . . . . 0.0 111.55 179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.0 tpt85 -152.45 136.47 16.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.905 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.995 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -118.74 143.9 46.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.082 0.468 . . . . 0.0 111.651 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.895 HD13 ' HB3' ' A' ' 135' ' ' GLU . 3.8 mt -100.47 124.73 46.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.137 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.487 HD21 HG23 ' A' ' 95' ' ' THR . 2.7 m-80 -114.95 120.17 38.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.021 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 9.0 p90 -167.07 144.83 4.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.122 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.9 p -83.99 109.0 16.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.654 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.834 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -70.78 -93.75 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.558 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.435 ' HG3' ' OD1' ' A' ' 91' ' ' ASN . 12.8 ptt85 -74.8 -48.17 26.78 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.857 0.36 . . . . 0.0 110.351 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.435 ' OD1' ' HG3' ' A' ' 90' ' ' ARG . 20.2 p-10 -171.47 30.23 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.669 179.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.779 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.37 125.58 2.65 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.557 179.62 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.845 ' O ' HD12 ' A' ' 8' ' ' LEU . 52.6 Cg_endo -68.08 117.79 5.17 Favored 'Trans proline' 0 CA--C 1.513 -0.571 0 C-N-CA 123.273 2.649 . . . . 0.0 112.816 -179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -101.5 124.35 47.03 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.098 -0.956 . . . . 0.0 111.741 -179.438 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.487 HG23 HD21 ' A' ' 86' ' ' ASN . 32.7 m -90.53 112.04 23.57 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 32.5 t -109.06 108.96 26.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.642 -178.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.995 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.68 142.89 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 178.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.504 ' CE1' ' HG2' ' A' ' 45' ' ' PRO . 7.7 m-85 -126.3 133.61 51.36 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.581 ' CH2' HG21 ' A' ' 97' ' ' ILE . 14.5 m-90 -124.07 143.34 50.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.444 178.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.819 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -80.96 128.53 33.8 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 120.902 -0.319 . . . . 0.0 110.224 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.53 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -134.43 142.17 47.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.178 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 10.9 tt0 -119.5 115.28 23.71 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.646 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.792 HG12 HD23 ' A' ' 75' ' ' LEU . 11.9 m -72.24 129.2 35.66 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-O 121.304 0.574 . . . . 0.0 110.653 -179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' CD ' ' N ' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -61.69 -27.1 68.46 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.794 -178.058 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.477 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 1.3 m-20 -106.35 132.77 52.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.111 0.481 . . . . 0.0 111.969 -178.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -69.09 -43.25 74.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.458 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -100.21 24.02 9.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.811 178.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.477 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 2.9 p -41.89 147.22 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.114 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.135 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' CD ' ' A' ' 111' ' ' ARG . 0.4 OUTLIER -61.75 144.64 54.37 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-O 121.306 0.574 . . . . 0.0 110.768 -179.331 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.907 HG21 ' CD1' ' A' ' 119' ' ' TYR . 30.5 mm -124.26 96.81 4.08 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.928 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.536 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 15.2 mtp180 -106.77 99.77 9.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.97 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.746 HD22 HD22 ' A' ' 34' ' ' LEU . 8.3 mt -85.68 172.86 10.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.815 -0.629 . . . . 0.0 111.528 -179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.11 -172.72 2.36 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.847 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -60.13 -29.57 68.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.142 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -75.09 -6.98 52.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.779 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.457 ' CD2' ' HB3' ' A' ' 34' ' ' LEU . 52.9 m80 -142.05 127.88 19.36 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.0 110.995 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.401 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -101.26 -18.94 15.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.513 -179.771 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -155.03 163.67 39.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 111.43 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.907 ' CD1' HG21 ' A' ' 110' ' ' ILE . 38.5 p90 -138.25 175.16 9.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.713 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.421 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 4.1 mtt85 -158.68 158.66 34.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.125 0.488 . . . . 0.0 111.509 -179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CE2' HD13 ' A' ' 32' ' ' LEU . 87.5 m95 -127.1 106.74 9.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.62 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.625 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -138.15 167.62 21.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.066 0.46 . . . . 0.0 111.585 -178.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.74 -153.51 3.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.748 -0.739 . . . . 0.0 111.707 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.03 -46.69 22.89 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.843 0.322 . . . . 0.0 110.845 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.2 pt-20 -56.14 -49.34 74.23 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.55 -179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.9 -50.68 22.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 120.852 -0.339 . . . . 0.0 110.551 -179.503 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.546 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.38 -29.63 10.5 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 178.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 2.3 m -83.94 -33.94 24.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.392 178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.29 -41.43 94.12 Favored 'General case' 0 CA--C 1.524 -0.049 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.585 179.846 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.554 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -77.6 -44.33 28.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.88 179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.88 52.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.142 178.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.401 ' O ' ' HE3' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -37.8 -34.11 0.1 Allowed 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.131 -179.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.478 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 21.2 m-85 -54.8 114.77 1.84 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.127 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -45.8 -50.81 13.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.519 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.895 ' HB3' HD13 ' A' ' 85' ' ' LEU . 11.3 mp0 -46.03 -46.97 16.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.624 -179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.583 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -71.36 -45.24 63.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.696 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.61 -30.24 12.89 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 179.337 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -79.77 -47.01 15.94 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.842 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 1.031 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.61 -47.47 63.6 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.032 0.444 . . . . 0.0 110.423 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.583 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -73.86 -27.67 61.2 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.024 178.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.553 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.19 -51.45 53.42 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.639 179.654 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -67.06 -30.74 70.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.55 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -55.5 -56.62 22.66 Favored Glycine 0 C--N 1.333 0.368 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.948 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 46.0 t-80 -67.78 -28.26 67.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.771 0.319 . . . . 0.0 110.45 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 8.4 tp60 -68.55 -43.71 76.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.896 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -72.67 -52.58 14.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.256 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.574 HD11 ' CE2' ' A' ' 16' ' ' PHE . 32.2 mt -52.23 -34.84 47.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.363 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -16.75 64.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.658 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 8.6 t -90.5 -10.74 42.49 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.264 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.563 HD11 HD23 ' A' ' 147' ' ' LEU . 0.3 OUTLIER -95.74 -142.3 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 179.7 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -142.9 -68.52 0.35 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.938 0.399 . . . . 0.0 110.479 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -163.76 -42.59 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.089 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.946 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.834 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.545 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -72.39 -36.99 4.72 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 124.332 3.355 . . . . 0.0 109.624 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.8 142.68 58.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.077 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.42 -137.07 9.85 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.553 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 61.9 m -98.58 -18.51 18.09 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.799 0.333 . . . . 0.0 110.994 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.404 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -58.27 172.9 0.4 Allowed 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.929 0.395 . . . . 0.0 110.562 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.595 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 66.99 163.6 0.19 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.916 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.952 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -104.11 127.82 51.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.113 -179.719 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.58 121.83 25.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.024 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -138.74 160.52 39.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.827 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 44.9 m -148.19 123.66 10.36 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.237 0.541 . . . . 0.0 111.146 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.411 ' CA ' ' HB3' ' A' ' 47' ' ' LYS . . . -114.85 170.94 13.45 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.678 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.727 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -124.67 117.24 23.81 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.859 0.361 . . . . 0.0 110.798 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.863 HD11 ' HB1' ' A' ' 139' ' ' ALA . 62.8 mt -82.87 92.32 2.61 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.433 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.818 HD11 HG23 ' A' ' 64' ' ' THR . 26.1 mt -82.64 145.73 8.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.186 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.664 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 29.0 p90 -149.62 124.08 9.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.837 -178.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.66 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -87.12 113.51 22.92 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.939 0.4 . . . . 0.0 110.654 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 18' ' ' ARG . 5.9 ttp85 -86.71 113.39 22.53 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.316 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 81.4 m -72.2 159.96 33.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.635 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.514 HD23 HG13 ' A' ' 21' ' ' ILE . 3.9 tp -59.83 -82.36 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.846 -179.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.514 HG13 HD23 ' A' ' 20' ' ' LEU . 2.1 pp -114.54 148.39 40.17 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 120.661 0.267 . . . . 0.0 111.081 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 9.1 Cg_exo -72.06 158.77 51.66 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.831 2.354 . . . . 0.0 112.857 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.84 -78.49 0.59 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.524 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.561 ' O ' HG12 ' A' ' 24' ' ' VAL . 18.7 t -88.28 3.62 5.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.391 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 64.26 19.33 11.74 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.248 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -110.74 -71.6 0.76 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.874 0.369 . . . . 0.0 110.795 179.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -95.75 118.28 32.11 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.427 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -127.68 -48.47 1.39 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.917 0.389 . . . . 0.0 111.446 -179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.664 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.0 mt -101.17 148.33 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.616 -179.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.587 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 16.8 mp0 -134.86 134.27 40.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.725 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -96.35 150.04 21.03 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -82.97 135.93 34.71 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.098 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.54 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.2 mt -135.54 142.65 45.43 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.868 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.637 HD22 ' CD2' ' A' ' 112' ' ' LEU . 8.8 mt -123.29 113.63 19.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.08 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.9 tt0 -69.09 122.26 18.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.875 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.39 130.27 45.96 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.426 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 90.8 p -73.36 0.32 12.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.519 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -146.56 -164.98 2.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.485 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.87 -130.13 33.19 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.564 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.4 pt -95.58 9.22 5.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.512 0.196 . . . . 0.0 111.405 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.43 57.21 1.53 Allowed 'General case' 0 CA--C 1.521 -0.165 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -107.45 150.44 26.77 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.832 -178.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.686 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 10.1 m95 -95.84 139.21 32.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -155.05 136.64 9.41 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.748 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 73.7 Cg_exo -49.17 169.08 0.11 Allowed 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 121.781 1.654 . . . . 0.0 111.018 179.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 1.5 Cg_endo -78.16 101.06 1.43 Allowed 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.027 1.818 . . . . 0.0 112.141 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HB3' ' CA ' ' A' ' 12' ' ' GLY . 0.3 OUTLIER -120.88 -173.11 2.52 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.036 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -167.46 -139.41 2.67 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.352 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 14.3 m80 -131.57 127.23 36.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.68 0.276 . . . . 0.0 110.578 179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.554 ' HB ' ' OG1' ' A' ' 59' ' ' THR . 0.2 OUTLIER -81.6 135.51 24.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 CA-C-O 120.95 0.405 . . . . 0.0 110.599 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CG ' ' HB2' ' A' ' 54' ' ' GLU . 0.0 OUTLIER -87.18 170.43 12.1 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.004 -179.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.461 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 76.8 Cg_exo -49.68 -63.29 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.793 2.328 . . . . 0.0 112.87 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.9 19.27 42.77 Favored Glycine 0 CA--C 1.519 0.289 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.432 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.464 ' HB2' ' CG ' ' A' ' 51' ' ' GLU . 30.5 tt0 -90.6 160.77 15.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.976 0.388 . . . . 0.0 110.754 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.906 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -85.31 162.69 18.99 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.057 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.532 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.6 OUTLIER -72.13 -62.98 1.24 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.086 0.47 . . . . 0.0 110.737 179.94 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD21 HG21 ' A' ' 77' ' ' ILE . 21.9 tp -61.97 -42.53 99.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.316 -179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.906 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.2 mt-10 -50.35 -46.87 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.73 0.3 . . . . 0.0 110.516 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.554 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 87.6 m -54.63 -37.36 65.56 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.09 -32.74 50.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.122 178.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.679 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.2 mt -70.95 -53.46 14.84 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.872 179.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.73 -38.86 89.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.038 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.53 -33.79 76.73 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.045 179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.818 HG23 HD11 ' A' ' 15' ' ' ILE . 90.0 m -58.55 -51.92 67.86 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.393 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.544 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.63 -20.96 61.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.919 179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -78.67 -41.67 30.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.755 0.312 . . . . 0.0 111.17 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.555 ' O ' HD13 ' A' ' 34' ' ' LEU . 13.8 mt-10 -108.08 6.34 26.87 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.614 -179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.713 ' HB2' ' HG3' ' A' ' 46' ' ' PRO . . . -148.24 -7.96 0.4 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.625 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 70.95 -1.94 20.87 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.143 -1.027 . . . . 0.0 113.241 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.741 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.4 mt -100.92 127.67 53.86 Favored 'Isoleucine or valine' 0 C--N 1.335 -0.042 0 CA-C-N 117.035 0.418 . . . . 0.0 110.811 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.1 pm0 -108.32 166.6 10.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.12 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.71 -34.55 5.24 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.734 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.41 -23.78 77.24 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.292 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.527 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 2.9 mm-40 -93.72 -5.83 47.56 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.395 0.14 . . . . 0.0 111.233 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.826 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.42 -171.35 2.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.996 0.427 . . . . 0.0 110.64 178.775 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.8 m -138.98 99.02 3.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.107 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.591 HG13 HD21 ' A' ' 61' ' ' LEU . 7.6 mm -71.58 120.38 19.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.448 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.33 131.33 34.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.221 0.534 . . . . 0.0 110.937 -179.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -90.59 148.81 22.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.211 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.72 -24.32 30.03 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.285 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CE1' HD21 ' A' ' 100' ' ' LEU . 17.0 t80 -103.71 125.62 50.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.691 0.282 . . . . 0.0 110.864 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.456 ' HD2' ' HZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.09 123.59 4.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.263 0.554 . . . . 0.0 111.414 179.599 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.5 tpt85 -152.34 138.16 18.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.683 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.951 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.3 OUTLIER -114.69 134.02 55.41 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.005 0.431 . . . . 0.0 111.429 -179.691 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.679 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.2 mt -91.11 122.67 33.96 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.524 179.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -115.89 123.49 48.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.33 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 19.1 p90 -167.05 142.03 4.03 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.823 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.605 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.2 p -82.02 109.86 16.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.245 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.622 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -77.29 -98.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.007 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.27 -38.3 84.86 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.717 0.294 . . . . 0.0 110.935 -179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 176.79 27.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.076 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.809 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -158.82 130.67 4.09 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.478 -179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.884 ' O ' HD12 ' A' ' 8' ' ' LEU . 47.6 Cg_endo -66.46 120.46 7.59 Favored 'Trans proline' 0 CA--C 1.516 -0.392 0 C-N-CA 123.381 2.721 . . . . 0.0 113.024 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.952 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -101.31 123.21 45.05 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.794 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -95.73 109.0 21.36 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.0 t -108.41 108.82 26.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.977 -178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.951 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.14 125.29 40.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.56 ' HB3' HG13 ' A' ' 14' ' ' ILE . 32.7 m-85 -111.74 165.43 12.06 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -177.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.532 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 4.7 m-90 -152.68 138.56 18.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.292 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.696 ' N ' HD23 ' A' ' 100' ' ' LEU . 0.3 OUTLIER -75.84 124.92 28.11 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.524 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.565 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -131.49 143.71 50.61 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.357 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.0 tt0 -117.6 110.67 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.766 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.758 HG12 HD23 ' A' ' 75' ' ' LEU . 10.9 m -72.27 143.55 13.97 Favored 'Isoleucine or valine' 0 C--O 1.232 0.147 0 CA-C-O 121.386 0.613 . . . . 0.0 111.589 -179.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.533 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 3.8 mptp? -71.59 -12.53 61.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.043 -0.98 . . . . 0.0 112.885 -177.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.561 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 6.5 t70 -133.35 127.61 33.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.895 0.379 . . . . 0.0 111.931 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.66 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 59.7 t80 -62.54 -38.43 89.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.889 179.163 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -100.3 21.3 13.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.695 178.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.561 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -43.03 145.82 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.523 -0.064 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.632 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -61.85 140.19 58.29 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.32 0.581 . . . . 0.0 110.621 -179.337 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.812 HG21 ' CG ' ' A' ' 119' ' ' TYR . 28.6 mm -123.74 95.2 3.2 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.879 179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.625 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.1 mtp85 -95.3 102.32 14.12 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.158 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.637 ' CD2' HD22 ' A' ' 34' ' ' LEU . 11.4 mt -90.65 144.49 25.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.11 -179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 60.7 p -89.09 -156.27 0.38 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -80.59 7.0 11.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.698 -0.228 . . . . 0.0 111.449 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -99.12 -29.86 12.63 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.767 0.317 . . . . 0.0 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.435 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.9 m80 -120.61 157.36 29.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.823 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -120.16 -21.4 7.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.694 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -154.59 178.6 9.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.914 0.388 . . . . 0.0 111.507 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.812 ' CG ' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -156.56 161.05 39.99 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.866 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.686 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -148.97 148.39 29.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.038 0.447 . . . . 0.0 111.383 179.588 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 81.2 m95 -105.96 106.9 17.62 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.3 169.71 17.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.002 0.43 . . . . 0.0 111.666 -178.26 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.33 -151.83 3.93 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.763 179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 11.9 tp -77.54 -45.62 24.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.767 0.318 . . . . 0.0 111.351 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -58.47 -52.19 66.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.803 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -69.02 -46.7 67.29 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.558 -179.554 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.54 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.54 -31.12 63.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.298 0.57 . . . . 0.0 109.763 178.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.4 m -82.57 -30.84 29.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.183 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.73 -43.55 88.7 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.725 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.636 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -77.73 -37.42 49.31 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.217 179.311 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.521 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.95 56.52 1.97 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.151 0.501 . . . . 0.0 110.085 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.438 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.57 -34.06 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.255 -179.464 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.423 ' HE2' " O4'" ' A' ' 154' ' ' ATP . 38.5 m-85 -59.5 115.32 3.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.185 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 tttp -46.17 -44.92 16.38 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.381 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.679 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.2 mp0 -49.31 -60.24 2.99 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.264 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.553 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -54.37 -40.23 67.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.921 -179.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.416 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -53.41 -39.58 64.43 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.607 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.21 -44.39 30.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.378 179.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.863 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.19 -42.74 63.75 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.246 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -79.67 -29.52 40.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.015 178.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.607 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.92 -52.24 45.59 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.823 179.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -66.22 -28.91 69.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.424 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.412 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.1 -53.67 42.82 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.605 -0.807 . . . . 0.0 111.833 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.61 ' NE2' HD12 ' A' ' 29' ' ' ILE . 18.0 t-80 -71.24 -30.23 66.07 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.93 0.395 . . . . 0.0 110.106 179.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -64.82 -50.3 67.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.347 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.418 ' CE1' ' CD1' ' A' ' 150' ' ' ILE . 48.6 t80 -62.39 -52.08 65.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.738 179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.803 HD23 HD11 ' A' ' 150' ' ' ILE . 67.6 mt -55.03 -30.18 58.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.5 t -83.02 -8.43 59.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.594 178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.73 -22.45 14.4 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.299 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.803 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -67.24 -124.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 179.995 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.448 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 2.5 tp10 -97.1 -60.4 1.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.896 0.379 . . . . 0.0 110.247 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -56.38 118.55 4.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.101 179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.848 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.622 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.525 ' C ' ' H ' ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.542 0 N-CA-C 110.256 -1.138 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -72.32 26.32 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.232 0 C-N-CA 124.294 3.329 . . . . 0.0 109.642 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.525 ' H ' ' C ' ' A' ' 1' ' ' GLY . 6.9 mp 59.56 -176.01 0.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.959 0.409 . . . . 0.0 111.123 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.52 -178.49 16.59 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.044 -0.598 . . . . 0.0 112.259 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.01 18.16 6.1 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.727 0.299 . . . . 0.0 111.098 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.6 ptm -61.06 168.38 2.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.975 0.416 . . . . 0.0 110.654 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.623 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 59.26 167.51 0.06 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.37 179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.62 142.18 41.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.524 179.644 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.713 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.7 mtt180 -78.56 137.77 38.05 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.639 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.655 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -149.56 162.61 39.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.919 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.599 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 16.6 m -156.42 123.5 5.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.17 0.51 . . . . 0.0 111.54 179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.62 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -113.47 178.0 18.29 Favored Glycine 0 N--CA 1.451 -0.303 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.555 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.742 HD11 HD23 ' A' ' 61' ' ' LEU . 1.1 mt -135.1 118.2 16.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.047 0.424 . . . . 0.0 111.801 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.497 HG12 ' HB3' ' A' ' 98' ' ' TYR . 11.2 mm -75.67 90.9 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.418 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.837 HD11 HG23 ' A' ' 64' ' ' THR . 30.2 mt -84.97 136.65 22.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.711 -178.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.687 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.9 p90 -146.47 124.05 11.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.828 -178.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.736 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.47 113.21 18.49 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.008 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 11.8 ttp180 -94.53 117.44 30.13 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.424 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.2 160.35 25.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.017 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 28.2 mt -59.07 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.022 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.778 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.8 pp -111.24 145.94 33.55 Favored Pre-proline 0 CA--C 1.53 0.173 0 CA-C-O 120.647 0.26 . . . . 0.0 111.163 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 7.0 Cg_exo -73.68 159.23 46.07 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.928 2.419 . . . . 0.0 112.604 -179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.53 -78.7 0.59 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.69 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 24' ' ' VAL . 16.5 t -109.5 0.5 9.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.576 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 63.57 47.47 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.007 0.432 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -114.2 -51.76 2.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.629 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 29' ' ' ILE . 3.9 m-20 -110.57 -75.57 0.62 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.177 179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 65.41 -65.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.501 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.687 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 12.3 mt -102.88 147.71 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.183 0.516 . . . . 0.0 111.485 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.616 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.4 mp0 -135.85 141.39 44.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.659 179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.588 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 53.4 m-85 -103.37 149.71 24.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.927 0.394 . . . . 0.0 112.018 -178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.566 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 43.5 tp -84.02 136.64 33.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.49 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 3.3 mt -136.95 143.13 42.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.609 179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 112' ' ' LEU . 19.9 mt -121.31 112.29 18.42 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.759 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.493 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 62.4 tt0 -60.68 134.22 56.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.315 -179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.59 133.44 47.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.626 179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.4 p -80.66 5.58 15.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.526 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -168.56 -177.0 2.98 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.744 0.306 . . . . 0.0 110.652 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.82 -119.29 4.82 Favored Glycine 0 CA--C 1.521 0.417 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.636 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.615 HD11 ' HB3' ' A' ' 42' ' ' HIS . 3.6 pt -100.29 9.25 8.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.546 0.212 . . . . 0.0 111.471 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 61.69 37.4 15.92 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 121.453 0.644 . . . . 0.0 109.643 -178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.615 ' HB3' HD11 ' A' ' 40' ' ' ILE . 15.0 p-80 -86.09 170.98 11.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.659 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.524 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 45.6 m95 -115.69 112.61 22.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.959 0.409 . . . . 0.0 111.267 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -125.63 143.73 45.88 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.66 171.39 12.11 Favored 'Trans proline' 0 C--N 1.344 0.341 0 C-N-CA 122.194 1.93 . . . . 0.0 111.97 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.432 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 25.2 Cg_endo -61.49 96.24 0.13 Allowed 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.436 2.091 . . . . 0.0 112.109 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.687 ' O ' ' HB1' ' A' ' 63' ' ' ALA . 7.3 mttt -86.63 170.64 11.65 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.847 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.5 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -166.58 128.58 1.77 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.696 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.69 109.91 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.82 0.343 . . . . 0.0 110.949 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.713 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -79.42 137.02 22.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 121.097 0.475 . . . . 0.0 111.15 -179.814 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.563 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 4.1 tt0 -95.12 151.48 38.82 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.277 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 7.4 Cg_endo -52.57 -31.02 47.45 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.71 2.273 . . . . 0.0 112.88 -179.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.563 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -91.2 -13.38 58.86 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.508 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -87.24 161.44 18.0 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.53 0.205 . . . . 0.0 110.684 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 31.1 t70 -78.29 160.89 27.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.364 179.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 15.5 m-20 -71.6 -62.21 1.5 Allowed 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.253 -179.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.699 HD21 HG21 ' A' ' 77' ' ' ILE . 24.8 tp -62.32 -40.44 96.35 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.299 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -50.32 -45.01 54.5 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.733 -179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.543 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 90.2 m -60.06 -41.81 93.16 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.62 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.23 -31.3 69.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.785 178.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.904 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -73.5 -52.19 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.642 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -59.5 -44.09 93.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.57 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.687 ' HB1' ' O ' ' A' ' 47' ' ' LYS . . . -58.77 -37.1 75.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.046 0.45 . . . . 0.0 110.045 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.837 HG23 HD11 ' A' ' 15' ' ' ILE . 34.7 m -60.32 -54.02 50.65 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.299 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.562 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 10.7 pt20 -73.23 -21.7 60.58 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.915 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -79.32 -41.69 27.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.219 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 17.5 mp0 -106.1 2.58 27.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.722 -179.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.689 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.59 -8.99 0.64 Allowed 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.611 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 72.51 1.02 51.04 Favored Glycine 0 CA--C 1.521 0.439 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.934 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.622 ' CG2' HD23 ' A' ' 75' ' ' LEU . 3.9 mt -103.7 122.23 56.12 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.138 0 CA-C-O 120.998 0.428 . . . . 0.0 110.833 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.7 pt-20 -107.24 168.55 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.441 -179.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.904 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.18 -36.13 8.3 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.507 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.62 78.84 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.109 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 0.2 OUTLIER -91.52 -6.6 52.25 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.704 0.288 . . . . 0.0 111.06 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.821 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -135.9 -176.2 4.23 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.86 0.362 . . . . 0.0 110.24 178.852 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.538 ' H ' ' H ' ' A' ' 102' ' ' GLU . 94.7 m -124.63 103.24 8.02 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.726 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.699 HG21 HD21 ' A' ' 57' ' ' LEU . 14.2 mm -77.63 109.79 12.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.905 0.383 . . . . 0.0 111.569 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.768 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -72.42 138.3 21.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.701 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -94.27 148.84 21.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.468 -179.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.87 -23.09 34.86 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.736 179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.621 ' CD1' HD21 ' A' ' 100' ' ' LEU . 34.4 t80 -100.71 125.25 47.14 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.897 0.38 . . . . 0.0 111.075 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.52 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.48 126.09 5.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.176 0.512 . . . . 0.0 111.273 179.693 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -153.81 137.44 16.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.202 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.919 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -118.08 134.6 54.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.942 0.401 . . . . 0.0 111.35 179.913 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.784 HD13 ' CB ' ' A' ' 135' ' ' GLU . 8.1 mt -101.62 117.82 35.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.481 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.24 126.51 53.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.144 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -166.93 140.23 3.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.646 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.6 p -80.41 108.82 14.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.557 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.732 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -76.62 -95.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.587 -178.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.496 ' HG2' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -69.98 -39.15 76.11 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.72 0.295 . . . . 0.0 110.875 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.496 ' N ' ' HG2' ' A' ' 90' ' ' ARG . 6.2 t-20 176.41 29.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.853 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.646 ' N ' HG23 ' A' ' 88' ' ' VAL . 0.0 OUTLIER -157.65 123.99 2.51 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.737 179.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.6 Cg_endo -73.43 117.63 5.16 Favored 'Trans proline' 0 CA--C 1.515 -0.436 0 C-N-CA 123.025 2.483 . . . . 0.0 112.832 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 2.1 mmmt -103.0 121.73 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.146 -0.934 . . . . 0.0 112.349 -179.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.549 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 55.2 m -88.74 113.61 24.49 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.74 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.9 t -112.44 109.41 28.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.136 -0.483 . . . . 0.0 112.222 -177.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.919 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -84.92 130.14 36.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.497 ' HB3' HG12 ' A' ' 14' ' ' ILE . 37.4 m-85 -115.62 137.7 51.81 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.605 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.8 m-90 -125.92 143.83 50.92 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.113 179.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.768 HD12 HG21 ' A' ' 78' ' ' ILE . 6.2 mt -75.5 123.84 26.15 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.858 -0.337 . . . . 0.0 110.514 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.547 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -131.98 144.16 50.6 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.423 179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.538 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.7 tt0 -123.64 112.63 17.64 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.601 0.238 . . . . 0.0 111.111 -179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.736 HG22 ' HG2' ' A' ' 17' ' ' ARG . 3.4 m -72.81 112.77 9.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.751 0.786 . . . . 0.0 110.387 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -8.78 14.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.517 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.876 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 6.1 m-20 -112.43 107.04 15.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.942 0.401 . . . . 0.0 111.142 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.417 ' CD1' ' HD2' ' A' ' 17' ' ' ARG . 2.7 t80 -55.47 -39.78 70.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.281 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -101.09 26.18 7.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.69 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.876 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.5 p -47.9 146.47 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.325 -0.852 . . . . 0.0 111.347 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.423 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 5.9 pm0 -68.68 143.09 54.86 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.118 0.485 . . . . 0.0 110.542 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.833 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.2 mm -120.97 97.55 5.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.511 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.611 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 19.5 mtp180 -101.84 99.92 10.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.435 -179.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.78 HD22 HD22 ' A' ' 34' ' ' LEU . 3.1 mt -92.06 -172.6 3.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.822 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 6.7 t -125.97 -172.57 2.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.811 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -66.58 -25.01 66.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.329 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -78.75 -12.53 60.03 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.29 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.413 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 81.7 m-70 -124.26 105.94 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.792 0.33 . . . . 0.0 110.764 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.52 -17.0 60.81 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.876 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.24 -179.57 2.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.126 0.489 . . . . 0.0 111.703 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.833 ' CD1' HG21 ' A' ' 110' ' ' ILE . 42.3 p90 -145.65 171.89 14.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.717 -179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.442 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 64.9 mtt180 -157.94 153.25 25.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.244 0.545 . . . . 0.0 111.675 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.566 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 90.6 m95 -118.03 107.14 13.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.367 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.771 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -136.63 173.59 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.045 0.45 . . . . 0.0 111.684 -178.555 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -79.94 -153.24 8.25 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.798 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.46 -41.16 40.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.0 pt-20 -61.05 -51.93 67.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.749 0.309 . . . . 0.0 111.413 -179.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.771 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.36 -48.72 60.44 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.904 0.383 . . . . 0.0 110.227 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.55 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -53.94 -27.25 29.87 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.411 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -83.23 -32.89 26.24 Favored 'General case' 0 CA--C 1.528 0.115 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.952 178.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.722 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.76 -46.99 82.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.019 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.66 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.4 OUTLIER -78.3 -37.19 45.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.864 0.364 . . . . 0.0 110.512 179.212 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.509 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -75.36 52.22 0.6 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.069 0.461 . . . . 0.0 110.813 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.76 -32.26 0.08 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.62 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.539 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 26.0 m-85 -63.4 120.53 11.81 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.617 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.61 -49.41 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.006 0.431 . . . . 0.0 111.175 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.784 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.9 mp0 -47.25 -53.24 13.86 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.673 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.522 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -60.03 -43.0 95.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.186 -179.243 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.5 OUTLIER -53.29 -36.57 61.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.411 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.571 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.01 -42.43 32.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.255 179.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.431 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.881 179.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.55 HD22 ' HB1' ' A' ' 127' ' ' ALA . 1.2 mt -78.39 -27.52 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.984 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.571 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -69.19 -51.85 33.8 Favored 'General case' 0 CA--C 1.521 -0.152 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.854 179.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.21 -30.04 67.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.393 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.57 -49.52 72.84 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.823 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.444 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 6.4 t-160 -76.25 -36.32 58.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.053 0.454 . . . . 0.0 110.273 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 68.3 tp60 -61.02 -52.72 63.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.533 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -60.94 -50.56 72.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.016 0.436 . . . . 0.0 111.191 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.871 HD23 HD11 ' A' ' 150' ' ' ILE . 94.0 mt -56.88 -31.71 65.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.678 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.16 -4.18 54.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.797 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.1 8.94 20.21 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.795 -179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.871 HD11 HD23 ' A' ' 147' ' ' LEU . 0.7 OUTLIER -94.67 -136.62 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 120.877 -0.329 . . . . 0.0 110.578 -179.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -100.9 -62.62 1.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.745 0.307 . . . . 0.0 111.446 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -82.98 126.8 32.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.694 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.132 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.812 179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.732 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.838 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.514 0 N-CA-C 110.277 -1.129 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.838 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 81.7 Cg_endo -72.36 89.52 0.81 Allowed 'Trans proline' 0 N--CA 1.447 -1.24 0 C-N-CA 124.389 3.393 . . . . 0.0 109.567 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.746 HD12 ' HB3' ' A' ' 5' ' ' SER . 0.5 OUTLIER -67.28 136.38 54.8 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.921 0.391 . . . . 0.0 110.748 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.36 56.09 4.4 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.821 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.746 ' HB3' HD12 ' A' ' 3' ' ' LEU . 73.4 p -72.3 155.85 39.74 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.667 0.27 . . . . 0.0 110.564 179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 59.19 159.38 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.685 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.647 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 58.74 164.69 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.037 0.446 . . . . 0.0 111.063 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.988 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.4 139.9 43.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.043 -179.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.796 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.4 OUTLIER -83.92 123.71 30.24 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.993 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -137.45 163.52 30.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.939 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 6.4 m -157.75 124.04 4.8 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.009 0.433 . . . . 0.0 111.146 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.581 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.53 170.13 13.27 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.488 179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.611 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -123.55 117.91 26.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.769 0.318 . . . . 0.0 110.945 179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.854 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.5 mt -86.77 91.74 3.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.996 HD11 HG23 ' A' ' 64' ' ' THR . 52.7 mt -79.94 146.31 7.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.622 -178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.665 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 51.4 p90 -151.33 122.27 7.61 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.439 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.11 112.24 18.97 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.69 128.52 45.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.548 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -65.0 160.17 21.42 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.341 179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.558 HD12 HG13 ' A' ' 21' ' ' ILE . 0.3 OUTLIER -50.11 -30.97 12.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.762 0.315 . . . . 0.0 111.163 -179.747 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.558 HG13 HD12 ' A' ' 20' ' ' LEU . 1.3 pp -165.64 151.93 8.71 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.673 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.67 159.15 42.85 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.846 2.364 . . . . 0.0 112.119 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -138.91 -80.08 0.32 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.046 179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 24' ' ' VAL . 21.6 t -95.92 -9.89 9.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.363 179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.6 t70 67.36 33.98 5.04 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.895 0.379 . . . . 0.0 110.236 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -91.47 -71.11 0.65 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.469 -179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -127.06 33.77 4.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.271 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -52.54 -24.22 7.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.275 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.665 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.9 mt -129.02 140.43 49.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.453 . . . . 0.0 111.99 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -135.24 126.93 29.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.001 179.234 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.0 m-85 -89.7 150.46 22.31 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.673 HD23 HD12 ' A' ' 15' ' ' ILE . 44.0 tp -85.88 138.53 31.97 Favored 'General case' 0 CA--C 1.523 -0.059 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.866 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.517 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 9.5 mt -139.13 132.77 30.52 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.824 0.345 . . . . 0.0 110.751 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.566 HD11 ' HG3' ' A' ' 46' ' ' PRO . 17.0 mt -108.92 100.2 9.44 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.93 -179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 41.1 tt0 -55.08 133.95 49.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.168 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.21 136.93 58.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.922 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.472 ' HA ' ' CB ' ' A' ' 117' ' ' GLN . 23.9 p -70.7 0.65 6.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.631 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -173.22 -165.16 0.27 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.783 0.325 . . . . 0.0 110.676 179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.22 -126.11 7.7 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.557 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.592 HD11 ' HB3' ' A' ' 42' ' ' HIS . 0.9 OUTLIER -94.36 8.17 5.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 61.77 42.75 10.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.35 0.595 . . . . 0.0 109.52 -178.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.592 ' HB3' HD11 ' A' ' 40' ' ' ILE . 24.2 p-80 -91.17 142.6 27.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.791 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.563 ' CE2' HD22 ' A' ' 130' ' ' LEU . 5.9 m95 -101.63 128.5 47.89 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.49 -179.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.438 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.2 OUTLIER -137.51 139.4 27.19 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.265 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 40.7 Cg_exo -56.87 164.34 6.22 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.244 1.962 . . . . 0.0 111.975 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.566 ' HG3' HD11 ' A' ' 34' ' ' LEU . 29.0 Cg_exo -60.34 83.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.528 0.186 0 C-N-CA 122.669 2.246 . . . . 0.0 112.314 -179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.48 153.09 19.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.038 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.4 -154.83 6.45 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.088 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -125.36 109.33 12.64 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.547 0.213 . . . . 0.0 110.912 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.796 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -83.21 132.59 31.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 121.153 0.501 . . . . 0.0 110.977 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.543 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 2.6 tt0 -95.07 152.15 39.3 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.417 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.543 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 4.9 Cg_endo -49.26 -31.29 21.87 Favored 'Trans proline' 0 C--N 1.342 0.23 0 C-N-CA 122.945 2.43 . . . . 0.0 112.831 -179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.535 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -94.97 -10.66 57.33 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.304 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -88.6 158.71 18.17 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.512 0.196 . . . . 0.0 110.589 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.852 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.2 t0 -76.78 160.34 29.37 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.736 -0.385 . . . . 0.0 110.012 179.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.92 -61.5 1.83 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.221 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.468 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 15.6 tp -61.39 -42.14 98.25 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.747 0.308 . . . . 0.0 111.076 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.852 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.26 -46.7 55.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.373 -179.819 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.609 HG21 ' N ' ' A' ' 50' ' ' VAL . 89.2 m -55.66 -42.32 74.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.432 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.33 -32.7 68.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.059 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.922 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.5 mt -71.19 -52.97 16.12 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.603 179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 mtt180 -58.09 -39.28 78.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.748 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.6 -30.39 71.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.114 0.483 . . . . 0.0 109.945 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.996 HG23 HD11 ' A' ' 15' ' ' ILE . 18.5 m -65.04 -50.94 64.25 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.64 179.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.57 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.5 pp0? -76.05 -24.85 55.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.933 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -79.04 -37.56 38.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.902 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -104.27 -8.81 19.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.911 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.623 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.42 -3.25 1.73 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.79 0.24 32.08 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.619 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.618 HG21 HD23 ' A' ' 75' ' ' LEU . 2.3 mt -103.95 123.99 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.09 0 CA-C-O 120.979 0.419 . . . . 0.0 110.688 179.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.81 167.12 10.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.922 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -48.53 -27.62 2.85 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.251 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.29 -21.03 76.44 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.227 179.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HG2' HG23 ' A' ' 70' ' ' ILE . 1.2 tp60 -98.06 -9.39 26.03 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 111.497 0.184 . . . . 0.0 111.497 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.793 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -126.03 -171.23 2.34 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.097 0.475 . . . . 0.0 110.514 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.447 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 83.9 m -133.85 100.67 4.82 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.385 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.61 HD13 ' HB2' ' A' ' 101' ' ' ALA . 8.1 mm -74.14 118.38 19.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.92 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.517 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.74 132.83 30.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 19.4 mt-10 -91.04 148.57 22.3 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.122 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.1 -26.8 19.44 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.588 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.481 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.6 t80 -103.49 124.26 48.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.839 0.352 . . . . 0.0 111.038 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 127.93 6.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.196 179.606 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -156.89 142.68 17.74 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.169 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.946 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.2 pm0 -120.87 141.4 50.63 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.105 0.479 . . . . 0.0 111.816 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.867 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -101.36 118.73 37.55 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.078 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.408 ' ND2' HG23 ' A' ' 95' ' ' THR . 1.0 OUTLIER -111.42 124.44 52.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.144 0.497 . . . . 0.0 111.038 -179.258 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.571 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 25.6 p90 -167.08 145.86 5.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.823 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.61 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.4 p -85.62 111.86 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.764 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.498 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -75.43 -106.34 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.278 -179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -39.61 93.43 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.858 0.361 . . . . 0.0 110.555 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 9.4 t30 178.25 30.1 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.968 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.776 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -156.45 125.4 3.03 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.826 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.3 116.49 4.64 Favored 'Trans proline' 0 CA--C 1.513 -0.561 0 C-N-CA 123.206 2.604 . . . . 0.0 112.825 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.988 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -99.95 128.39 46.05 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.699 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.408 HG23 ' ND2' ' A' ' 86' ' ' ASN . 52.6 m -95.59 104.95 16.89 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.663 -0.865 . . . . 0.0 108.663 177.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.653 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 36.2 t -104.05 108.43 24.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.081 -0.508 . . . . 0.0 111.966 -178.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.946 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.38 136.62 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.466 ' CZ ' HG11 ' A' ' 96' ' ' VAL . 37.2 m-85 -123.49 129.86 51.85 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.473 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 3.8 m-90 -115.03 148.88 38.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.026 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.523 HD13 ' HG ' ' A' ' 147' ' ' LEU . 6.6 mt -83.29 127.47 33.68 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.61 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.97 144.6 48.87 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.627 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.432 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -123.31 116.74 23.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.793 0.33 . . . . 0.0 111.396 -179.635 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.751 HG12 HD23 ' A' ' 75' ' ' LEU . 4.8 m -76.93 121.04 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 121.447 0.642 . . . . 0.0 110.833 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.407 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.99 -22.24 66.7 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.522 -179.26 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.784 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 4.6 m-20 -104.94 119.83 39.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.987 0.422 . . . . 0.0 111.712 -179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.66 -43.88 95.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.168 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -96.22 21.26 9.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.079 178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.784 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -42.26 145.94 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.367 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.707 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -62.03 141.2 58.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.318 0.58 . . . . 0.0 111.3 -179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.925 HG21 ' CD2' ' A' ' 119' ' ' TYR . 35.4 mm -123.99 100.48 7.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.707 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -99.67 101.61 12.85 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.416 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.512 HD11 ' HD2' ' A' ' 119' ' ' TYR . 17.3 mt -92.75 163.87 13.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.71 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -117.43 -168.9 1.56 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.243 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.2 m170 -64.46 -18.53 64.85 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.347 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.93 -18.25 35.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.688 0.28 . . . . 0.0 111.17 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 77.3 m-70 -120.02 136.78 54.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.535 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.472 ' CB ' ' HA ' ' A' ' 37' ' ' SER . 6.6 tp60 -109.74 -19.17 13.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.533 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.52 166.25 16.39 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.869 0.366 . . . . 0.0 111.198 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.925 ' CD2' HG21 ' A' ' 110' ' ' ILE . 43.0 p90 -139.74 173.59 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.841 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.461 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 26.4 mtt-85 -160.68 158.33 28.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.169 0.509 . . . . 0.0 111.486 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.462 ' CE2' HD13 ' A' ' 32' ' ' LEU . 86.3 m95 -122.09 107.4 12.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.28 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.731 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.67 172.7 12.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.065 0.46 . . . . 0.0 111.833 -178.198 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.0 -151.47 6.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.233 179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.559 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.9 tp -77.3 -46.05 24.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.574 0.226 . . . . 0.0 111.539 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.7 pt-20 -58.18 -51.43 69.75 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.496 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.731 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -67.55 -54.1 22.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.069 0.461 . . . . 0.0 110.242 -179.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.555 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -49.87 -31.11 11.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.172 0.51 . . . . 0.0 110.157 179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.7 m -83.86 -30.79 26.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.736 179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.588 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -63.87 -43.4 96.18 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.788 -179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.563 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -77.66 -42.55 34.28 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.184 179.394 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.79 54.39 0.98 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.003 0.43 . . . . 0.0 110.165 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.67 -33.9 0.09 Allowed 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.302 -179.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.513 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 53.2 m-85 -59.59 120.54 9.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.676 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.38 -54.71 8.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.246 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.867 ' HB3' HD13 ' A' ' 85' ' ' LEU . 21.4 mp0 -41.67 -54.74 3.17 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.143 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.616 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.01 -44.64 95.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.206 -179.203 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.03 -42.58 49.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.907 0.384 . . . . 0.0 109.994 179.439 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.505 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.45 -45.04 73.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.76 179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.854 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.16 -42.62 66.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 136' ' ' MET . 0.4 OUTLIER -81.81 -29.2 32.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.319 179.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.559 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -62.71 -51.62 66.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.904 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -72.84 -29.24 63.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.483 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.97 -45.08 72.3 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.215 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 59.4 t-80 -80.41 -29.48 37.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.882 0.372 . . . . 0.0 110.63 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -67.01 -52.63 40.18 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.243 -179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.421 ' CE1' HD11 ' A' ' 150' ' ' ILE . 44.2 t80 -63.3 -49.29 74.58 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.827 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.546 HD23 HD11 ' A' ' 150' ' ' ILE . 78.7 mt -57.26 -32.93 67.09 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.838 -179.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -70.32 -16.64 63.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.8 0.333 . . . . 0.0 110.946 179.762 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.06 -7.98 50.28 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.513 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.546 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -91.07 -139.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 110.438 -0.208 . . . . 0.0 110.438 -179.734 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -152.07 -53.06 0.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -168.1 -174.94 2.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.078 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.828 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.571 ' C2 ' ' CD1' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.613 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.537 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.613 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 82.6 Cg_endo -72.42 175.52 9.95 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 124.356 3.37 . . . . 0.0 109.607 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -58.99 110.15 0.97 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.69 0.281 . . . . 0.0 110.884 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.16 174.76 21.54 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.558 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 5.1 m 60.17 106.13 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.869 0.366 . . . . 0.0 110.911 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.46 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -65.37 130.05 41.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.811 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.597 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 70.12 165.2 0.27 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.168 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.89 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -106.69 125.83 51.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.539 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' O ' ' CD2' ' A' ' 49' ' ' HIS . 0.3 OUTLIER -79.09 115.58 18.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.099 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' ' O ' ' A' ' 95' ' ' THR . . . -126.78 160.65 30.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.481 ' SG ' HG11 ' A' ' 50' ' ' VAL . 87.4 m -152.01 123.49 7.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.696 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.615 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -114.69 177.59 17.56 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.016 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.68 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -127.55 117.42 22.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.704 0.288 . . . . 0.0 111.44 -179.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.864 HD11 ' HB1' ' A' ' 139' ' ' ALA . 73.4 mt -83.95 91.37 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 177.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 17.3 mt -79.23 145.22 9.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.238 -178.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.609 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.8 p90 -148.37 121.95 9.18 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.849 -178.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.446 ' NH1' ' CE2' ' A' ' 121' ' ' TRP . 3.9 ttp180 -85.95 112.75 21.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.001 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -90.65 119.81 31.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.071 0.463 . . . . 0.0 111.439 -179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.2 160.52 30.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.745 179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.7 HD23 HG23 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -57.54 -82.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.32 -179.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.7 HG23 HD23 ' A' ' 20' ' ' LEU . 2.8 pp -123.92 149.67 60.44 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-O 120.784 0.326 . . . . 0.0 111.59 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_exo -65.28 167.57 16.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 122.739 2.292 . . . . 0.0 112.322 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.5 mtmt -144.39 -75.78 0.23 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.953 0.406 . . . . 0.0 111.001 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 1.3 m -74.67 -10.79 13.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.482 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.1 t0 69.74 25.47 5.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.193 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -109.89 -82.34 0.57 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.669 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.417 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 24.0 m120 -87.42 -175.68 5.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.189 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 27' ' ' ASN . . . 178.88 -48.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.768 0.318 . . . . 0.0 111.469 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.609 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.5 mt -112.31 141.8 26.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.068 0.461 . . . . 0.0 112.02 -179.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.0 OUTLIER -128.18 136.08 50.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.098 179.593 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.564 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 50.5 m-85 -95.66 154.37 17.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.935 0.398 . . . . 0.0 111.932 -179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.637 HD23 ' CD1' ' A' ' 15' ' ' ILE . 56.2 tp -86.93 134.41 33.51 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.496 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.2 mt -135.94 140.23 43.86 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.705 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 112' ' ' LEU . 43.3 mt -115.64 127.42 55.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.454 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -65.93 157.47 30.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.174 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.443 ' O ' ' OG ' ' A' ' 37' ' ' SER . . . -83.42 -14.63 52.21 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.721 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 117' ' ' GLN . 19.3 p 80.09 -32.18 0.13 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 122.852 0.461 . . . . 0.0 111.605 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.81 -166.47 2.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.696 0.284 . . . . 0.0 110.721 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 62.02 -127.16 40.19 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.436 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 40' ' ' ILE . 11.1 tt -86.67 -5.0 9.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-O 120.598 0.237 . . . . 0.0 111.341 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 65.0 33.23 9.86 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.839 0.352 . . . . 0.0 110.65 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.427 ' O ' ' CD2' ' A' ' 42' ' ' HIS . 5.8 p-80 -62.79 134.51 56.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.598 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.5 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 41.7 m95 -101.68 129.97 47.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 22.3 p -149.06 143.97 17.57 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.609 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -56.16 159.61 12.25 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.313 2.009 . . . . 0.0 112.034 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.592 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 42.9 Cg_exo -57.83 88.9 0.05 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.684 2.256 . . . . 0.0 112.321 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.615 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.1 OUTLIER -104.64 156.21 18.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.869 0.366 . . . . 0.0 111.319 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.45 -152.85 6.74 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.451 ' CD2' ' O ' ' A' ' 9' ' ' ARG . 9.8 t-80 -135.54 106.08 6.47 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.751 0.31 . . . . 0.0 111.211 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.585 ' N ' HG21 ' A' ' 59' ' ' THR . 1.5 p -78.64 129.45 37.52 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 CA-C-O 121.146 0.498 . . . . 0.0 111.472 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.583 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.2 tt0 -91.21 153.54 44.64 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.148 179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.548 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.8 Cg_endo -44.0 -38.46 10.35 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.108 2.538 . . . . 0.0 113.004 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.583 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.93 -4.16 63.49 Favored Glycine 0 CA--C 1.522 0.497 0 C-N-CA 120.577 -0.82 . . . . 0.0 112.982 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -91.32 154.6 19.12 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.723 0.261 . . . . 0.0 110.856 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.901 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 17.3 t70 -73.03 158.45 35.4 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.995 0.426 . . . . 0.0 110.104 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -74.58 -65.38 0.87 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.809 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.737 HD21 HG21 ' A' ' 77' ' ' ILE . 20.2 tp -59.71 -37.65 79.45 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.704 0.287 . . . . 0.0 110.754 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.1 mt-10 -50.27 -50.03 51.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.379 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.585 HG21 ' N ' ' A' ' 50' ' ' VAL . 20.7 m -54.7 -42.5 71.55 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -70.52 -32.33 69.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.887 178.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.89 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.0 mt -71.04 -52.31 20.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.312 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.5 mtt-85 -61.77 -42.81 99.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.464 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.419 ' HA ' ' HB3' ' A' ' 66' ' ' GLU . . . -60.36 -33.06 71.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.144 0.497 . . . . 0.0 110.236 179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 97.6 m -63.73 -49.28 73.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.36 179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.563 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 12.3 pt20 -80.32 -23.26 40.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.716 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.419 ' HB3' ' HA ' ' A' ' 63' ' ' ALA . 22.5 tp10 -79.0 -31.8 44.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.189 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -111.63 -14.6 13.61 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.625 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.653 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -130.69 -5.35 4.1 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.486 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.95 1.83 49.59 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.135 -1.031 . . . . 0.0 113.026 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.772 ' O ' HG22 ' A' ' 64' ' ' THR . 2.9 mt -104.11 125.33 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.126 0 CA-C-O 120.918 0.389 . . . . 0.0 110.619 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.1 pt-20 -105.69 168.38 9.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.847 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.89 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.47 -36.36 6.55 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.762 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.83 -22.44 76.94 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.563 -0.827 . . . . 0.0 111.99 179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.487 ' HB3' HG23 ' A' ' 70' ' ' ILE . 0.1 OUTLIER -93.21 -5.08 50.8 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.607 0.241 . . . . 0.0 111.191 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.864 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.21 -166.16 1.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.784 0.326 . . . . 0.0 110.376 178.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 90.3 m -139.33 97.85 3.38 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.513 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.737 HG21 HD21 ' A' ' 57' ' ' LEU . 11.1 mm -71.42 106.33 2.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.212 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.777 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.37 133.35 32.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.596 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -91.53 151.14 20.88 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.251 -179.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -21.51 40.36 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.884 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.481 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 19.9 t80 -105.36 127.78 53.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.791 0.329 . . . . 0.0 111.496 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.425 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 6.7 ttpt -158.52 128.06 5.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.208 0.528 . . . . 0.0 111.525 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -153.79 147.68 25.45 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.722 179.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.8 OUTLIER -128.27 138.04 52.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.189 0.518 . . . . 0.0 111.951 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.892 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.6 mt -99.45 124.75 44.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.122 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.616 HD21 HG23 ' A' ' 95' ' ' THR . 2.5 m-80 -114.21 124.76 52.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.32 -179.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.571 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 30.1 p90 -167.49 146.87 5.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.097 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.63 HG23 ' CA ' ' A' ' 92' ' ' LYS . 11.0 p -89.55 107.68 18.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.721 179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.802 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -74.91 -101.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.563 -179.099 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 90' ' ' ARG . 0.1 OUTLIER -60.47 -49.43 77.59 Favored 'General case' 0 N--CA 1.461 0.096 0 CA-C-O 120.91 0.386 . . . . 0.0 110.579 -179.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -174.07 27.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.187 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.843 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.59 131.43 5.94 Favored Pre-proline 0 CA--C 1.532 0.287 0 CA-C-O 120.931 0.396 . . . . 0.0 110.635 179.408 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.89 ' O ' HD12 ' A' ' 8' ' ' LEU . 57.9 Cg_endo -69.33 120.0 6.9 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.56 2.84 . . . . 0.0 112.869 -179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.836 ' HG2' HD13 ' A' ' 8' ' ' LEU . 18.3 mtpp -105.05 128.29 53.26 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.098 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.616 HG23 HD21 ' A' ' 86' ' ' ASN . 41.4 m -95.5 109.12 21.38 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.643 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 31.5 t -106.82 108.51 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -85.73 128.27 39.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.595 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.8 m-85 -116.63 131.45 56.95 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -177.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.542 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.3 m-90 -116.36 155.86 27.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.248 179.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.777 HD12 HG21 ' A' ' 78' ' ' ILE . 2.6 mt -89.83 124.42 34.65 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -133.08 137.1 46.26 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 120.75 0.309 . . . . 0.0 110.812 -179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CE1' ' A' ' 16' ' ' PHE . 13.8 tt0 -113.4 114.53 26.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.572 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.796 HG12 HD23 ' A' ' 75' ' ' LEU . 8.3 m -72.75 101.22 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 121.427 0.632 . . . . 0.0 110.311 179.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.423 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -56.83 -9.64 0.85 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.248 -0.887 . . . . 0.0 112.417 -178.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.854 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 9.8 m-20 -108.41 100.87 10.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.933 0.396 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.27 -38.81 59.29 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.992 0.425 . . . . 0.0 110.574 -179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.58 26.9 5.71 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.708 178.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.854 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.7 p -51.5 144.48 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.293 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -70.71 143.88 51.16 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.999 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.8 HG21 ' CD1' ' A' ' 119' ' ' TYR . 35.9 mm -121.7 98.97 6.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.48 179.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.486 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.04 103.14 15.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.85 -179.307 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.5 mt -91.81 173.18 8.0 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.03 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 32.9 p -117.15 -172.22 2.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.916 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -66.82 -12.49 59.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.668 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -90.7 -23.37 20.74 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.599 0.237 . . . . 0.0 111.184 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.548 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 39.1 m80 -113.93 118.92 35.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.933 0.397 . . . . 0.0 110.878 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 37' ' ' SER . 22.4 tp60 -85.35 -22.32 28.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.382 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.33 -177.14 3.93 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.927 0.394 . . . . 0.0 111.497 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.8 ' CD1' HG21 ' A' ' 110' ' ' ILE . 44.5 p90 -148.96 174.4 12.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.439 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 7.3 mtt180 -157.07 149.54 23.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.267 0.556 . . . . 0.0 111.851 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.534 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 94.6 m95 -112.78 106.83 15.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.325 178.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.29 167.61 21.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.1 0.476 . . . . 0.0 111.677 -178.461 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.8 -165.55 28.94 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.912 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.464 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.4 tp -64.54 -43.29 94.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.68 0.276 . . . . 0.0 111.234 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.99 -53.8 54.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.51 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.741 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -70.48 -48.28 56.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.937 0.399 . . . . 0.0 110.1 -179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.453 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -52.81 -26.93 15.99 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.444 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.8 OUTLIER -82.97 -38.58 22.49 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.804 178.571 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.741 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -58.33 -45.2 88.56 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.844 -179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.631 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.8 OUTLIER -78.71 -38.42 39.13 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.289 178.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.451 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.23 50.19 1.04 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.713 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.43 -32.36 0.07 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.479 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 34.3 m-85 -59.9 119.69 8.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.773 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 6.0 tttt -46.48 -50.16 17.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.569 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.892 ' HB3' HD13 ' A' ' 85' ' ' LEU . 35.6 mp0 -48.25 -54.76 12.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.139 -179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.622 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.17 -44.0 97.99 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.752 0.31 . . . . 0.0 110.934 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.444 ' HG2' ' SG ' ' A' ' 128' ' ' CYS . 0.0 OUTLIER -49.12 -39.28 27.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.158 179.237 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.7 -47.05 50.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.599 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.864 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.59 -46.72 67.07 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.322 179.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.441 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -75.45 -27.62 58.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.115 178.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.95 -51.8 55.28 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.209 179.828 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.481 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -73.79 -29.68 62.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.481 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.54 -50.32 66.12 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.424 -0.893 . . . . 0.0 111.757 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -70.25 -37.61 74.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.097 0.475 . . . . 0.0 110.077 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 45.9 tp60 -59.77 -52.49 65.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.245 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -55.08 -55.41 31.36 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.926 -179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.595 HD23 HD11 ' A' ' 150' ' ' ILE . 87.6 mt -58.56 -41.22 85.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 t -63.08 -12.96 30.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.788 0.328 . . . . 0.0 110.691 179.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.86 -22.53 17.4 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.297 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.595 HD11 HD23 ' A' ' 147' ' ' LEU . 3.7 mt -72.32 -124.01 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.782 -179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 71.79 79.26 0.16 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.245 0.545 . . . . 0.0 110.957 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -79.06 -10.95 59.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.099 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 7.3 tt . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.878 -179.899 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.802 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.532 0 N-CA-C 110.287 -1.125 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.28 112.47 3.45 Favored 'Trans proline' 0 N--CA 1.447 -1.234 0 C-N-CA 124.36 3.374 . . . . 0.0 109.634 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 113.66 2.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.808 0.337 . . . . 0.0 110.819 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -151.33 161.04 29.0 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.563 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.4 p -58.4 169.8 0.83 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.717 0.294 . . . . 0.0 111.082 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.04 122.95 14.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.837 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 58.96 167.33 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.098 0.475 . . . . 0.0 111.258 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.99 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -108.66 137.26 46.89 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.751 179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.486 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -81.84 129.72 34.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.828 179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.614 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -142.09 164.07 31.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.258 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 28.1 m -153.49 123.67 7.0 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.083 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -117.51 173.93 15.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.884 -0.674 . . . . 0.0 111.861 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.723 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.8 OUTLIER -127.89 117.89 22.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.959 0.38 . . . . 0.0 111.336 -179.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.898 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.8 mt -84.73 91.7 3.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 178.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.93 HD11 HG23 ' A' ' 64' ' ' THR . 52.4 mt -81.99 145.54 8.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.33 -178.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.656 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 42.9 p90 -148.98 121.41 8.48 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.776 -179.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.407 ' C ' ' HD3' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -84.59 113.81 21.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.03 0.443 . . . . 0.0 110.688 179.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.8 ttm180 -90.42 108.39 19.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.025 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.24 155.71 39.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.372 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.525 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -59.95 -81.74 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.459 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.815 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.0 pp -108.68 149.11 39.03 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.911 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -74.16 157.77 45.98 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.693 2.262 . . . . 0.0 112.254 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.75 -78.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.678 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.597 ' O ' HG12 ' A' ' 24' ' ' VAL . 16.8 t -101.91 11.48 7.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.555 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 61.47 47.75 6.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.959 0.409 . . . . 0.0 110.93 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -137.82 119.11 14.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.898 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 1.3 m-20 71.45 -69.48 0.18 Allowed 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.04 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 69.64 -62.66 0.41 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.436 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.656 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.7 mt -87.29 154.4 3.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.569 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.485 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.3 mt-10 -135.63 125.06 24.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.508 179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.542 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 52.0 m-85 -91.15 145.28 24.8 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.55 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.691 HD23 HD12 ' A' ' 15' ' ' ILE . 55.4 tp -85.09 138.93 32.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.05 179.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.456 ' O ' HD23 ' A' ' 34' ' ' LEU . 3.4 mt -139.11 144.21 38.58 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.692 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 112' ' ' LEU . 24.3 mt -122.69 107.23 11.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.752 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.543 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 4.3 tt0 -64.45 136.75 57.39 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.002 0.429 . . . . 0.0 111.314 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.18 150.3 34.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.819 179.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 p -89.83 19.13 4.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.962 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.1 t0 178.64 -163.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.43 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.95 -120.28 8.58 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.891 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.524 HD11 ' HB3' ' A' ' 42' ' ' HIS . 4.0 pt -101.15 9.31 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 64.78 22.72 12.6 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 121.419 0.628 . . . . 0.0 110.581 -179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.554 ' HE2' H5'1 ' A' ' 154' ' ' ATP . 15.9 p-80 -65.9 163.27 17.34 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.034 -0.984 . . . . 0.0 111.225 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.543 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 30.1 m95 -113.15 142.86 45.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.248 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.8 OUTLIER -158.86 138.54 8.56 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 170.41 2.83 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.547 2.164 . . . . 0.0 112.055 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.572 ' HG3' HD11 ' A' ' 34' ' ' LEU . 31.8 Cg_exo -58.81 99.79 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.58 2.186 . . . . 0.0 112.517 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.55 ' HD3' HG21 ' A' ' 96' ' ' VAL . 0.2 OUTLIER -94.12 148.94 21.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.611 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.475 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -131.16 178.76 17.54 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.839 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -121.17 90.69 3.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.663 0.268 . . . . 0.0 110.728 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.834 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -71.26 132.99 32.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.007 0.432 . . . . 0.0 111.04 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.534 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 1.4 tt0 -96.8 151.72 38.01 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.854 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 2.6 Cg_endo -47.84 -30.32 13.06 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.864 2.376 . . . . 0.0 112.704 -179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.528 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -96.74 -9.7 56.08 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.525 179.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -87.65 162.17 17.26 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.492 0.187 . . . . 0.0 110.632 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.861 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 11.8 t70 -78.45 161.35 27.17 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.997 0.427 . . . . 0.0 110.346 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.404 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 34.9 m-20 -74.24 -64.7 0.96 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.415 -179.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.569 HD21 HG21 ' A' ' 77' ' ' ILE . 10.6 tp -61.52 -40.14 93.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.226 -179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.861 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.92 -50.08 58.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.61 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.834 HG21 ' N ' ' A' ' 50' ' ' VAL . 99.5 m -55.34 -39.19 69.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.861 0.362 . . . . 0.0 110.144 179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.77 -38.86 67.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.685 178.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.875 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.9 mt -64.48 -52.91 55.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.518 179.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -43.78 97.42 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.47 -33.7 71.63 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.019 0.438 . . . . 0.0 110.156 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.93 HG23 HD11 ' A' ' 15' ' ' ILE . 23.8 m -60.53 -51.02 71.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.276 179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.533 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 8.2 pt20 -77.76 -25.11 48.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.048 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -76.52 -32.66 58.41 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.08 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.449 ' O ' HD13 ' A' ' 34' ' ' LEU . 2.9 mt-10 -114.92 -0.18 13.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.868 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.736 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.04 -8.54 0.7 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.49 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 74.12 -1.32 49.2 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.183 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.646 HD11 ' CD1' ' A' ' 110' ' ' ILE . 3.0 mt -103.06 126.1 57.39 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 117.034 0.417 . . . . 0.0 111.231 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.439 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.3 pt-20 -109.92 169.35 8.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.0 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.875 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.5 -36.81 24.29 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.356 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.53 -15.63 68.62 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.394 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.437 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 1.5 tp-100 -101.48 -11.85 19.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.638 0.256 . . . . 0.0 111.299 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.18 -171.5 2.43 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 121.021 0.438 . . . . 0.0 110.512 179.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.452 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 88.2 m -132.6 99.77 4.74 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.664 179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.569 HG21 HD21 ' A' ' 57' ' ' LEU . 10.0 mm -71.63 120.52 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.191 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.566 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -80.66 136.51 23.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.877 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -94.82 150.62 20.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.227 -179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.42 -18.5 55.23 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.867 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.838 ' CD1' HD21 ' A' ' 100' ' ' LEU . 14.3 t80 -109.74 128.06 55.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.874 0.368 . . . . 0.0 111.207 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.445 ' HG3' ' CE2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -157.74 130.93 7.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.051 179.477 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -153.57 140.7 19.42 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.56 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.973 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.2 pm0 -119.46 124.23 46.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.786 0.327 . . . . 0.0 111.08 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.59 HD13 ' CB ' ' A' ' 135' ' ' GLU . 7.3 mt -91.15 125.31 35.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.522 179.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -118.03 121.42 40.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.487 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.41 ' CD2' ' OE2' ' A' ' 135' ' ' GLU . 22.9 p90 -167.11 142.66 4.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.81 179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.562 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -77.63 112.56 15.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.398 179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.676 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -83.53 -98.19 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.528 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -43.23 98.26 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.915 0.388 . . . . 0.0 110.637 -179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 178.08 31.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.572 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.789 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -163.42 129.54 2.28 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.344 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.878 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.9 Cg_endo -66.81 119.41 6.43 Favored 'Trans proline' 0 CA--C 1.514 -0.523 0 C-N-CA 123.328 2.686 . . . . 0.0 112.912 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.99 ' HG2' HD13 ' A' ' 8' ' ' LEU . 1.2 mmmt -103.5 120.75 41.46 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.974 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 55.9 m -85.59 106.43 16.89 Favored 'General case' 0 CA--C 1.52 -0.2 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.1 t -105.11 108.58 25.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.102 -177.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.973 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.49 129.03 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.519 ' HB3' HG13 ' A' ' 14' ' ' ILE . 44.5 m-85 -117.61 158.34 24.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.431 0.634 . . . . 0.0 112.682 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.47 ' CH2' HG21 ' A' ' 97' ' ' ILE . 8.4 m-90 -143.73 150.61 38.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.889 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.2 OUTLIER -86.22 121.33 28.66 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -129.81 147.19 51.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.122 -179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.519 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.9 OUTLIER -121.81 116.17 23.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.205 -179.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.785 HG12 HD23 ' A' ' 75' ' ' LEU . 10.0 m -76.02 116.27 18.78 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.302 0.572 . . . . 0.0 110.989 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -24.98 63.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.725 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.805 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 22.1 m-20 -99.29 112.76 24.87 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.142 0.496 . . . . 0.0 111.418 -179.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -57.46 -45.64 84.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.181 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -97.26 25.19 5.73 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.861 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.805 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 3.2 p -43.92 145.28 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.004 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 4.8 pm0 -66.35 142.1 57.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.294 0.568 . . . . 0.0 110.998 -179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.6 mm -121.75 98.15 5.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.714 179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.49 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.9 OUTLIER -101.16 101.83 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.999 -179.373 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.696 HD22 HD22 ' A' ' 34' ' ' LEU . 12.8 mt -87.9 173.15 9.1 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.159 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -122.3 -167.07 1.5 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.989 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -68.68 -14.07 62.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.403 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.03 -17.87 31.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.692 0.282 . . . . 0.0 111.427 -179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.452 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 90.2 m-70 -130.17 129.63 43.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.785 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -21.26 18.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.701 -179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.78 -177.66 6.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.989 0.424 . . . . 0.0 111.643 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 43.1 p90 -156.46 169.19 25.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.468 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.449 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.5 OUTLIER -160.86 154.64 22.4 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 111.569 179.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 93.2 m95 -111.12 107.44 16.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.632 178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.516 HD13 ' CD1' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -134.12 168.35 19.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.378 -178.553 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.16 -152.53 5.91 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.724 -0.75 . . . . 0.0 111.946 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.435 HD21 ' HA ' ' A' ' 141' ' ' GLN . 9.1 tp -77.11 -45.8 25.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.853 0.327 . . . . 0.0 111.334 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.474 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -58.04 -48.97 78.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.593 -179.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.797 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -72.46 -48.98 36.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.881 0.372 . . . . 0.0 110.514 -179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.452 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -53.15 -30.11 35.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.326 0.584 . . . . 0.0 109.772 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.65 -32.79 25.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.408 179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.797 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.0 -42.13 97.27 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.461 179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.611 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -78.28 -41.67 33.22 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.359 179.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.465 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.7 55.97 1.11 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.726 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.406 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.32 -33.14 0.09 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.259 -179.742 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.549 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 21.1 m-85 -57.69 113.36 1.79 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.43 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -46.59 -41.2 14.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.392 -179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.59 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.6 mp0 -55.01 -51.53 65.98 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.185 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.648 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -62.85 -44.79 95.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.088 -179.756 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.427 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -49.67 -39.51 36.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.965 0.412 . . . . 0.0 109.915 179.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.591 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.43 -45.55 45.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.543 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.898 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.77 -44.32 63.35 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.173 0.511 . . . . 0.0 110.215 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.648 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.04 -28.18 43.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.224 179.194 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.591 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.04 -51.99 53.14 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.62 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.81 -29.98 68.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.386 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.409 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.21 -57.02 21.26 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.577 -0.82 . . . . 0.0 111.807 179.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.458 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.7 t-160 -67.87 -33.1 74.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.762 0.315 . . . . 0.0 110.262 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -63.02 -52.55 62.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.455 ' CE1' HD11 ' A' ' 150' ' ' ILE . 46.2 t80 -64.33 -47.68 78.47 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.458 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.597 HD23 HD11 ' A' ' 150' ' ' ILE . 45.1 mt -57.31 -28.72 63.33 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.443 179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.1 OUTLIER -80.38 -14.16 58.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.931 0.396 . . . . 0.0 110.425 179.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 69.3 m -92.22 -11.82 34.34 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.283 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.597 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -84.78 -136.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' A' ' 152' ' ' ALA . 1.1 tt0 -160.71 -71.65 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.814 0.34 . . . . 0.0 110.75 179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.402 ' HB2' ' O ' ' A' ' 151' ' ' GLU . . . 178.14 90.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.964 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 7.2 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.901 -179.835 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.676 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.531 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -72.4 105.93 1.97 Allowed 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 124.26 3.307 . . . . 0.0 109.539 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.95 -21.91 14.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.087 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.48 -164.06 27.83 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.431 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.44 31.34 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.844 0.355 . . . . 0.0 110.793 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.25 129.94 41.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.724 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 65.02 166.95 0.17 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.315 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.948 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.66 140.18 39.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.453 179.569 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.696 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.82 131.69 35.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.132 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.61 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -144.26 165.09 28.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.849 179.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.597 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 18.7 m -155.88 123.59 5.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.183 0.516 . . . . 0.0 111.418 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.55 175.45 16.15 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.586 178.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.694 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.0 OUTLIER -130.92 117.53 19.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.153 0.476 . . . . 0.0 111.518 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.97 HD11 ' HB1' ' A' ' 139' ' ' ALA . 44.9 mt -84.33 91.27 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.349 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 177.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.948 HD11 HG23 ' A' ' 64' ' ' THR . 21.2 mt -79.01 146.11 8.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 114.856 -1.065 . . . . 0.0 111.686 -177.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.754 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.2 p90 -152.48 122.9 7.23 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.568 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.77 113.76 19.18 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.647 179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' CB ' ' HG3' ' A' ' 102' ' ' GLU . 22.8 ttm180 -94.12 116.52 28.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.313 -179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 89.7 m -74.8 159.4 31.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.593 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.801 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -61.81 -82.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.964 -179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.801 HG13 HD12 ' A' ' 20' ' ' LEU . 1.9 pp -112.69 147.06 36.32 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-O 120.689 0.281 . . . . 0.0 111.158 179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 5.4 Cg_exo -79.37 160.67 25.85 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 123.014 2.476 . . . . 0.0 112.205 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.79 -77.94 0.6 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.152 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 15.5 t -95.09 -9.49 9.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.166 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 73.47 31.71 1.3 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.866 0.365 . . . . 0.0 110.713 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -61.59 -85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.992 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 7.6 p30 -118.83 -39.44 2.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.968 0.413 . . . . 0.0 110.206 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 70.37 -56.62 0.59 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.724 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.754 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.6 mt -102.47 151.03 6.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.116 0.484 . . . . 0.0 111.943 -179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 2.3 mt-10 -137.76 129.57 28.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.821 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.603 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 51.2 m-85 -91.91 148.86 21.89 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.602 HD23 ' CD1' ' A' ' 15' ' ' ILE . 46.4 tp -85.15 137.08 33.25 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.925 178.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.6 mt -137.13 138.31 40.17 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.872 0.368 . . . . 0.0 111.057 -179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' A' ' 46' ' ' PRO . 11.1 mt -118.21 119.08 33.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.642 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.468 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 40.9 tt0 -82.48 133.84 35.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.538 -179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.77 149.42 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.691 179.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.791 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 0.3 OUTLIER -89.0 14.45 10.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.901 -179.606 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -170.15 -176.89 2.37 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.983 0.42 . . . . 0.0 111.056 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 67.39 -133.17 30.42 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.569 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.558 ' O ' HG12 ' A' ' 40' ' ' ILE . 10.4 tt -81.65 -0.56 4.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.681 0.277 . . . . 0.0 111.432 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.3 m-70 59.35 33.38 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.869 0.366 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 43.6 p-80 -60.63 156.0 17.62 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.974 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.533 ' CG ' ' HB3' ' A' ' 130' ' ' LEU . 78.1 m95 -104.32 131.8 51.25 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.936 -179.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.762 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -158.07 156.31 27.76 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.959 -179.791 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -75.8 176.89 9.42 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.378 2.052 . . . . 0.0 111.984 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.58 ' HG3' HD11 ' A' ' 34' ' ' LEU . 39.2 Cg_exo -60.58 114.58 2.2 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.542 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -103.61 142.35 34.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.047 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -132.62 172.52 21.23 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.235 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -120.9 95.13 4.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.814 0.34 . . . . 0.0 111.122 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.738 ' N ' HG21 ' A' ' 59' ' ' THR . 1.9 p -70.1 132.25 33.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.694 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.5 tt0 -96.98 152.4 38.32 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.85 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 1.1 Cg_endo -45.12 -33.99 8.82 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 123.018 2.479 . . . . 0.0 112.866 -179.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.694 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -93.37 -10.42 59.41 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.594 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -86.45 168.0 14.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.608 0.242 . . . . 0.0 110.795 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.853 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.5 t70 -85.95 161.37 19.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 110.698 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.458 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -73.67 -65.67 0.8 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.867 -179.389 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.77 HD21 HG21 ' A' ' 77' ' ' ILE . 22.2 tp -62.28 -38.94 91.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.307 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.853 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.88 -50.17 57.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.468 -179.908 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.738 HG21 ' N ' ' A' ' 50' ' ' VAL . 61.4 m -54.64 -38.98 67.52 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.597 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -74.07 -31.11 62.71 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.043 178.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.893 HD22 ' HB2' ' A' ' 72' ' ' ALA . 82.5 mt -74.18 -53.04 10.67 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.882 179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -60.36 -42.96 96.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.542 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.94 -33.82 71.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.019 0.438 . . . . 0.0 110.038 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.948 HG23 HD11 ' A' ' 15' ' ' ILE . 32.7 m -62.45 -54.24 43.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.586 179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.574 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.1 OUTLIER -71.56 -21.16 61.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.165 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -79.61 -42.64 24.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.743 0.306 . . . . 0.0 111.017 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -105.49 6.16 32.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.637 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.61 -8.59 0.37 Allowed 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.461 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 70.88 0.92 36.44 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.409 -0.901 . . . . 0.0 113.233 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.574 ' N ' ' HA ' ' A' ' 65' ' ' GLN . 1.3 mt -104.23 121.43 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 CA-C-O 120.968 0.414 . . . . 0.0 110.778 179.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.43 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.3 pm0 -104.89 169.35 8.49 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.872 -179.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.893 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -52.54 -26.78 14.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.879 0.371 . . . . 0.0 110.705 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.413 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -75.05 -11.1 84.16 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.108 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.428 ' HG2' HG23 ' A' ' 70' ' ' ILE . 70.0 tp60 -110.58 -16.07 13.73 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.455 0.169 . . . . 0.0 111.102 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.853 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -119.55 -170.17 1.89 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.935 0.397 . . . . 0.0 110.512 179.131 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.514 ' H ' ' H ' ' A' ' 102' ' ' GLU . 60.4 m -136.36 102.13 4.87 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.172 -179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.77 HG21 HD21 ' A' ' 57' ' ' LEU . 9.7 mm -74.11 124.31 31.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.286 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.495 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.95 136.04 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.281 0.562 . . . . 0.0 111.273 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -96.31 147.83 23.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.261 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.61 -29.59 11.17 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.466 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.888 ' CD1' HD21 ' A' ' 100' ' ' LEU . 20.0 t80 -102.95 129.79 49.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.76 0.314 . . . . 0.0 110.886 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -157.56 129.05 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.102 0.477 . . . . 0.0 111.413 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -149.15 136.01 19.71 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.133 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.953 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.0 pm0 -122.31 127.79 50.26 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.952 0.406 . . . . 0.0 111.24 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.017 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.1 mt -91.84 120.66 32.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.499 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -109.84 124.47 51.37 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.597 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.581 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 23.5 p90 -166.83 144.3 4.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.814 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.611 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.7 p -85.15 108.88 17.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.909 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.794 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -78.94 -97.93 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.158 -179.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -62.28 -50.09 73.06 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-O 120.861 0.363 . . . . 0.0 110.682 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -175.1 29.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.244 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.727 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -161.69 130.45 3.03 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.515 179.47 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.841 ' O ' HD12 ' A' ' 8' ' ' LEU . 51.3 Cg_endo -68.32 117.8 5.2 Favored 'Trans proline' 0 CA--C 1.518 -0.313 0 C-N-CA 123.204 2.603 . . . . 0.0 112.789 -179.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.948 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -100.98 117.35 34.85 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.206 -0.906 . . . . 0.0 111.86 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.42 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 54.7 m -80.75 112.54 18.22 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 177.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.6 t -110.47 108.42 25.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.656 -178.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.953 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.0 130.24 36.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.57 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.5 m-85 -115.52 128.81 56.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.025 0.441 . . . . 0.0 112.089 -178.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.612 ' CD2' HD13 ' A' ' 57' ' ' LEU . 4.2 m-90 -116.36 146.82 42.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.097 178.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.888 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -83.46 113.97 21.14 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 179.36 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.549 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.58 147.01 46.38 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.916 -179.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.565 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.6 tm-20 -123.0 115.45 21.91 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.337 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.764 HG12 HD23 ' A' ' 75' ' ' LEU . 10.7 m -73.27 122.99 27.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.243 0.544 . . . . 0.0 110.499 179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 2.5 mttt -59.94 -26.31 65.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.847 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.674 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 54.1 t0 -105.81 125.69 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.928 0.394 . . . . 0.0 111.828 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -41.09 99.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.283 0.563 . . . . 0.0 109.645 179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -100.03 24.13 8.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.541 178.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.674 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 3.5 p -40.93 152.08 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.215 -179.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.712 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 3.0 pm0 -62.16 139.81 58.45 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-O 121.331 0.586 . . . . 0.0 111.161 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.893 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.6 mm -124.52 96.95 4.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.705 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.712 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -101.6 99.67 9.98 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.436 -178.702 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.679 HD11 ' HD1' ' A' ' 119' ' ' TYR . 12.9 mt -92.82 161.18 14.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.912 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 m -113.57 -169.24 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.389 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -65.99 -13.96 60.78 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.225 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -84.97 -18.97 32.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.038 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 63.1 m-70 -134.3 109.65 8.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.726 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.791 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 6.7 pt20 -88.99 2.13 54.45 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.0 160.61 6.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.062 0.458 . . . . 0.0 111.673 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.893 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.2 p90 -140.13 173.02 11.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.51 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.635 ' NH1' HD21 ' A' ' 130' ' ' LEU . 28.4 mtp180 -157.14 156.31 32.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.217 0.532 . . . . 0.0 111.967 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.456 ' CE2' HD13 ' A' ' 32' ' ' LEU . 92.3 m95 -122.35 107.13 11.73 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.471 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.716 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -139.33 172.15 13.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.064 0.459 . . . . 0.0 111.794 -178.322 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.82 -154.5 7.93 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.956 179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.5 tp -76.39 -41.83 46.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.745 0.307 . . . . 0.0 111.291 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.418 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.9 pt-20 -61.21 -50.3 73.67 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.404 -179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.847 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.29 -42.67 65.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.715 -179.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.518 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -59.58 -30.6 68.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.9 m -82.45 -35.75 27.22 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.143 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.847 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -61.37 -43.17 99.33 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.78 179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.635 HD21 ' NH1' ' A' ' 120' ' ' ARG . 1.5 mt -77.6 -44.7 27.51 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.002 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -78.99 56.1 1.9 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.017 178.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.91 -34.92 0.17 Allowed 'General case' 0 CA--C 1.517 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.186 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.454 ' HD1' ' H ' ' A' ' 133' ' ' PHE . 9.8 m-85 -53.36 114.87 1.64 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.4 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -45.36 -50.18 12.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.28 -179.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 1.017 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.7 mp0 -48.14 -53.1 17.84 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.516 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.762 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.11 -47.25 85.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.324 -179.087 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.5 -40.41 37.43 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.958 0.409 . . . . 0.0 110.352 179.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.589 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.91 -47.86 60.85 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.945 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.97 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.11 -44.31 64.38 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-O 121.241 0.543 . . . . 0.0 109.919 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -76.88 -27.3 54.96 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.078 179.033 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.589 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.82 -52.41 37.2 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.01 -179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -72.74 -28.89 62.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.441 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.493 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.21 -40.77 97.74 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.631 -0.795 . . . . 0.0 111.65 179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 1.2 t-160 -79.0 -27.39 43.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.033 0.444 . . . . 0.0 110.466 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 52.4 tp60 -73.46 -52.49 13.47 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.269 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -58.97 -52.2 66.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.138 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.689 HD23 HD11 ' A' ' 150' ' ' ILE . 74.5 mt -53.99 -42.81 69.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.449 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -13.03 60.3 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.478 179.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.71 -15.82 26.23 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.48 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.689 HD11 HD23 ' A' ' 147' ' ' LEU . 1.2 mt -80.97 -133.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -161.44 -69.65 0.06 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 110.623 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -157.7 -14.97 0.08 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.976 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.334 -0.106 0 CA-C-N 116.915 -0.13 . . . . 0.0 110.829 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.794 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.813 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.529 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.813 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 83.0 Cg_endo -72.4 95.69 0.79 Allowed 'Trans proline' 0 N--CA 1.448 -1.18 0 C-N-CA 124.307 3.338 . . . . 0.0 109.586 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.07 123.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.02 0.438 . . . . 0.0 110.925 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.65 -25.14 1.06 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.197 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.427 ' HB3' ' HD2' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -167.78 104.21 0.49 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.816 0.341 . . . . 0.0 110.699 179.879 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.59 ' O ' ' HG2' ' A' ' 6' ' ' MET . 0.0 OUTLIER -92.7 51.52 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.263 0.554 . . . . 0.0 111.07 -179.586 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.622 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 73.56 162.2 0.26 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.877 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.909 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -105.41 130.14 53.57 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.651 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.633 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -82.44 120.79 25.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.446 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -135.02 170.92 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.411 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.2 m -159.58 123.98 3.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.063 0.459 . . . . 0.0 111.098 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.73 178.97 19.12 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.765 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.78 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.1 mt -133.6 118.02 17.74 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.969 0.385 . . . . 0.0 111.469 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.029 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.2 mt -87.52 91.64 3.59 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 177.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.853 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -78.12 146.29 8.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.9 -1.045 . . . . 0.0 111.587 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.66 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 35.9 p90 -150.04 123.24 8.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -179.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -81.66 113.07 19.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -89.32 127.82 35.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.96 0.409 . . . . 0.0 112.046 -178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -92.99 159.73 15.18 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.217 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.41 HD12 HG13 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -68.64 -81.51 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.663 0.268 . . . . 0.0 110.699 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.644 ' O ' HD12 ' A' ' 21' ' ' ILE . 1.6 pp -107.55 150.34 39.99 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.229 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.87 164.78 33.77 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.814 2.343 . . . . 0.0 112.39 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.409 ' HE3' ' CD1' ' A' ' 21' ' ' ILE . 0.0 OUTLIER -115.11 -76.56 0.57 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.73 179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.401 ' O ' HG12 ' A' ' 24' ' ' VAL . 11.6 t -86.11 -8.23 11.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 78.6 5.14 2.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.153 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -95.2 -70.35 0.71 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.134 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.461 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 62.6 m-20 -89.63 -179.24 5.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.995 179.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.461 ' HB2' ' O ' ' A' ' 27' ' ' ASN . . . 176.54 -43.86 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.947 0.403 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.66 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -117.2 140.98 37.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.433 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.3 mp0 -126.91 138.51 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.889 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.545 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 49.8 m-85 -100.59 152.24 20.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.97 0.414 . . . . 0.0 112.05 -179.02 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' A' ' 15' ' ' ILE . 53.0 tp -84.02 134.37 34.63 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.774 178.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 43' ' ' TRP . 3.6 mt -132.62 142.41 49.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.863 0.363 . . . . 0.0 110.951 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 112' ' ' LEU . 3.4 mt -123.11 104.92 9.5 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.891 -179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.476 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -59.88 133.68 56.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.12 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -54.24 147.41 13.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.807 179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 88.6 p -80.64 2.69 24.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.738 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -175.09 174.1 2.51 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.819 0.342 . . . . 0.0 110.942 179.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 86.19 -131.94 10.83 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.652 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.568 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.3 tt -81.31 1.02 3.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.783 0.325 . . . . 0.0 111.501 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 64.08 29.11 14.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.898 0.38 . . . . 0.0 110.279 -179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.423 ' HB3' HG23 ' A' ' 40' ' ' ILE . 3.1 p-80 -64.98 146.48 54.94 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.603 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.744 ' HB3' HD22 ' A' ' 33' ' ' LEU . 63.7 m95 -97.38 130.52 44.52 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.173 -179.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.786 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -152.62 136.37 10.02 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.881 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.428 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 18.2 Cg_endo -57.37 179.91 0.12 Allowed 'Trans proline' 0 C--N 1.345 0.392 0 C-N-CA 122.866 2.377 . . . . 0.0 112.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.538 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.7 Cg_exo -63.91 117.09 4.11 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.644 2.229 . . . . 0.0 112.543 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -108.82 128.91 55.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.408 179.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.472 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -117.36 173.37 14.72 Favored Glycine 0 C--N 1.331 0.29 0 C-N-CA 120.553 -0.832 . . . . 0.0 113.351 -179.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -109.99 103.63 12.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.914 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.633 HG13 ' HB3' ' A' ' 9' ' ' ARG . 2.1 p -86.7 121.91 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.112 0.482 . . . . 0.0 110.919 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.509 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 1.5 tt0 -93.73 154.01 41.04 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.971 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.509 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 3.4 Cg_exo -42.4 -46.44 7.72 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.745 2.297 . . . . 0.0 112.35 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.458 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.64 -11.46 82.96 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.902 -0.666 . . . . 0.0 113.107 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -85.29 164.33 18.08 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.855 0.327 . . . . 0.0 110.969 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.851 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 25.1 t70 -85.08 159.24 20.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.208 0.528 . . . . 0.0 110.772 179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.412 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 21.3 m-20 -71.42 -66.42 0.63 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.344 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.618 HD21 HG21 ' A' ' 77' ' ' ILE . 12.1 tp -59.23 -40.44 85.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.279 -179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.851 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.85 -50.54 45.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.609 -0.269 . . . . 0.0 110.856 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.575 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.3 m -55.47 -36.05 66.18 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -75.84 -32.67 59.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.758 178.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.669 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.7 mt -73.37 -53.28 11.13 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.044 179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.7 ttt85 -57.9 -43.66 86.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.147 179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.472 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -59.79 -34.66 73.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.582 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.853 HG23 HD11 ' A' ' 15' ' ' ILE . 28.4 m -59.39 -53.63 55.96 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.521 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 4.9 pt20 -74.12 -21.44 59.88 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.91 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.17 -35.82 41.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.828 0.347 . . . . 0.0 110.968 179.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.429 ' HB3' HD13 ' A' ' 34' ' ' LEU . 8.1 mt-10 -112.24 6.63 19.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.85 -179.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -151.49 -12.15 0.21 Allowed 'General case' 0 N--CA 1.461 0.12 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.497 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 77.64 -2.76 62.24 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 120.29 -0.957 . . . . 0.0 112.784 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.619 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.9 mt -100.38 124.77 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-O 120.905 0.384 . . . . 0.0 110.831 179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -108.58 167.05 10.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.767 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.822 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -45.85 -38.54 7.43 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.648 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.38 -20.53 73.56 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.241 179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.421 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 6.5 tp60 -96.59 -5.68 38.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.519 0.199 . . . . 0.0 111.021 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.822 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.08 -168.81 2.15 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.906 0.384 . . . . 0.0 110.369 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.499 ' H ' ' H ' ' A' ' 102' ' ' GLU . 87.7 m -137.11 100.74 4.36 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.654 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.618 HG21 HD21 ' A' ' 57' ' ' LEU . 8.1 mm -72.94 125.27 31.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.962 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.491 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.62 133.38 29.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.292 0.568 . . . . 0.0 111.41 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -92.16 151.92 20.15 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.205 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 99.76 -22.24 41.33 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.657 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.879 ' CE1' HD21 ' A' ' 100' ' ' LEU . 14.2 t80 -106.03 131.7 53.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 110.911 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.507 ' HD2' ' NE1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.25 131.92 8.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.232 0.539 . . . . 0.0 111.109 179.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 83' ' ' ARG . 0.1 OUTLIER -159.39 139.32 11.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.081 179.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.906 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -126.39 134.27 51.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.913 0.387 . . . . 0.0 111.359 179.678 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.877 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.4 mt -93.18 118.74 31.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.263 179.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -110.98 125.67 53.96 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.113 0.482 . . . . 0.0 110.858 -179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.609 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 22.2 p90 -166.85 142.67 4.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.844 -179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.576 ' O ' HG13 ' A' ' 88' ' ' VAL . 7.4 p -81.73 112.34 19.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.019 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -71.4 -107.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.348 -179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -35.84 78.92 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.928 0.394 . . . . 0.0 110.748 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -179.93 28.55 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.857 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.741 ' HB3' HD11 ' A' ' 8' ' ' LEU . 1.9 tppt? -158.53 125.95 2.69 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-O 120.99 0.424 . . . . 0.0 111.321 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.769 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.2 Cg_endo -70.16 116.59 4.67 Favored 'Trans proline' 0 CA--C 1.513 -0.555 0 C-N-CA 123.358 2.706 . . . . 0.0 113.096 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.909 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -99.84 123.17 43.82 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.267 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.3 m -88.6 114.18 24.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.664 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 25.0 t -112.85 108.19 24.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.901 -178.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.906 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.29 128.6 39.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.602 ' HB3' HG13 ' A' ' 14' ' ' ILE . 20.3 m-85 -117.95 128.58 54.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.241 0.543 . . . . 0.0 112.269 -178.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.507 ' NE1' ' HD2' ' A' ' 82' ' ' LYS . 17.7 m-90 -109.99 167.48 10.14 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.579 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.879 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -103.03 110.91 23.0 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 178.537 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -118.23 154.49 32.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.308 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.499 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tt0 -130.97 115.24 16.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.088 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.726 HG12 HD23 ' A' ' 75' ' ' LEU . 5.3 m -73.97 122.2 26.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 CA-C-O 121.345 0.593 . . . . 0.0 111.273 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -24.12 66.25 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.166 -178.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.772 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.5 t0 -104.44 117.9 35.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.081 0.467 . . . . 0.0 112.041 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -57.62 -42.81 84.08 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.152 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.0 25.24 8.29 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.904 178.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.3 p -44.06 142.54 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.869 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.5 OUTLIER -63.53 142.45 58.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.252 0.549 . . . . 0.0 111.422 -179.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.808 HG21 ' CD1' ' A' ' 119' ' ' TYR . 36.5 mm -121.05 97.4 4.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.503 179.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.497 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 8.3 mtp180 -102.17 101.69 12.04 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.88 -179.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.615 HD22 HD22 ' A' ' 34' ' ' LEU . 10.1 mt -90.73 178.72 5.98 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.353 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -126.66 -158.27 0.85 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.996 -179.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -78.73 -3.45 44.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.4 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.78 -22.47 20.15 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.657 0.265 . . . . 0.0 111.104 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -132.37 116.71 17.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.41 179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -87.57 -3.49 58.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.913 -179.309 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -168.72 164.37 12.07 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.836 0.35 . . . . 0.0 111.4 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.808 ' CD1' HG21 ' A' ' 110' ' ' ILE . 41.0 p90 -141.33 168.12 20.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.625 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.435 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 6.1 mtt180 -156.45 159.76 38.96 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.452 -179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.1 m95 -124.26 107.64 11.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.638 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.595 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -136.33 172.74 12.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.98 0.419 . . . . 0.0 111.342 -178.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.56 -153.99 7.29 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.959 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.546 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.9 tp -77.21 -42.41 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.649 0.261 . . . . 0.0 111.157 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.454 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.5 pt-20 -60.81 -50.08 74.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.316 -179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.82 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -72.22 -46.9 54.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.651 -179.401 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.535 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -54.03 -30.65 48.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.414 0.626 . . . . 0.0 109.636 178.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.5 m -83.71 -34.45 24.9 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.021 -0.991 . . . . 0.0 110.52 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.82 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -63.04 -41.44 99.5 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 121.091 0.472 . . . . 0.0 109.938 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.594 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.1 mt -77.89 -45.88 22.93 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.129 179.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.489 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.0 53.74 1.22 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 178.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.437 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -38.18 -31.49 0.05 Allowed 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.585 -179.571 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.403 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 8.9 m-85 -57.19 115.94 2.97 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.13 0.49 . . . . 0.0 110.412 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -45.85 -40.01 9.29 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.473 -179.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.877 ' HB3' HD13 ' A' ' 85' ' ' LEU . 41.8 mp0 -58.1 -54.08 50.98 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.72 -179.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.786 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -63.42 -39.65 95.06 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.749 0.309 . . . . 0.0 110.489 -179.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.79 -37.95 60.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.974 0.416 . . . . 0.0 110.265 179.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.578 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.19 -46.01 36.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.946 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 1.029 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.25 -45.98 62.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.211 0.529 . . . . 0.0 110.314 179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.631 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.52 -29.78 59.58 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.045 179.012 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.578 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.54 -51.33 60.66 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.792 179.607 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -69.56 -29.67 67.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.61 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.8 -44.94 94.04 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.986 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.431 ' NE2' HD12 ' A' ' 29' ' ' ILE . 10.4 t-80 -78.78 -30.81 45.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.806 0.336 . . . . 0.0 110.419 179.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 72.3 tp60 -64.76 -52.36 57.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.78 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.5 ' CD2' HD11 ' A' ' 150' ' ' ILE . 84.6 t80 -61.56 -53.55 54.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.819 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.636 HD23 HD11 ' A' ' 150' ' ' ILE . 96.7 mt -56.02 -24.79 41.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.574 -179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 4.6 t -84.61 -10.93 56.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.532 178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 1.3 t -97.14 -18.49 19.27 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.871 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.636 HD11 HD23 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -74.03 -129.27 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.023 179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -160.14 -64.23 0.07 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.821 0.343 . . . . 0.0 111.018 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -158.28 -41.15 0.06 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.22 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.79 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.609 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.55 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.652 ' HG2' ' H ' ' A' ' 3' ' ' LEU . 83.3 Cg_endo -72.39 -77.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 124.357 3.371 . . . . 0.0 109.634 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.652 ' H ' ' HG2' ' A' ' 2' ' ' PRO . 5.6 mt -65.83 112.9 3.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.832 0.348 . . . . 0.0 110.863 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -144.41 69.59 0.4 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.573 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.403 ' HB3' ' CD ' ' A' ' 92' ' ' LYS . 0.8 OUTLIER -75.4 129.4 37.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.811 0.339 . . . . 0.0 110.853 179.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 8.1 tpt -77.75 131.1 37.49 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.05 0.452 . . . . 0.0 111.011 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.826 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . -58.77 158.28 8.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.696 0.76 . . . . 0.0 112.124 -179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.761 HD12 ' N ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -116.29 145.99 42.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.132 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.637 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.3 ttt85 -78.82 118.92 21.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.592 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.919 ' HB2' ' CE ' ' A' ' 94' ' ' LYS . . . -127.3 166.64 17.42 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.058 179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -159.24 123.84 4.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.078 0.466 . . . . 0.0 111.762 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.489 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -120.61 171.92 14.87 Favored Glycine 0 N--CA 1.451 -0.35 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.496 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.773 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -125.36 118.18 25.36 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 117.07 0.435 . . . . 0.0 111.976 -179.171 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.93 HD11 ' HB1' ' A' ' 139' ' ' ALA . 48.6 mt -86.24 91.74 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.985 HD11 HG23 ' A' ' 64' ' ' THR . 30.3 mt -78.88 142.82 13.53 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.049 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 50.0 p90 -145.52 121.33 10.58 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.329 -179.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.451 ' HG2' ' CD1' ' A' ' 106' ' ' TYR . 20.3 tpt180 -81.0 113.34 19.14 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.916 0.389 . . . . 0.0 110.075 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.15 125.26 38.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.666 -179.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -94.22 157.0 16.26 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.005 179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.644 HD23 HG23 ' A' ' 21' ' ' ILE . 0.4 OUTLIER -60.36 -80.9 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.724 -179.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.644 HG23 HD23 ' A' ' 20' ' ' LEU . 2.3 pp -110.25 152.15 43.03 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.595 0.236 . . . . 0.0 111.13 179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -60.12 156.72 38.12 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.787 2.325 . . . . 0.0 112.371 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.29 -78.49 0.59 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.918 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.546 ' O ' HG12 ' A' ' 24' ' ' VAL . 13.2 t -107.75 9.57 9.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.448 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 60.15 27.81 17.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.79 0.328 . . . . 0.0 110.817 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -107.34 -33.17 7.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.727 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -166.22 120.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.751 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -106.79 -37.64 6.33 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.203 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.72 HD12 ' NE2' ' A' ' 144' ' ' HIS . 6.5 mt -115.93 141.61 32.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.976 -179.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.578 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -128.84 141.77 51.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.991 179.351 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.586 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.7 m-85 -103.52 145.41 30.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.979 0.419 . . . . 0.0 111.843 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.549 HD23 HD12 ' A' ' 15' ' ' ILE . 52.1 tp -78.2 135.41 37.61 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.112 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.463 HD22 ' HB3' ' A' ' 43' ' ' TRP . 6.2 mt -134.23 145.4 49.12 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.002 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 112' ' ' LEU . 6.6 mt -123.16 113.46 18.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.088 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.469 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 4.0 tt0 -76.64 147.69 37.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.559 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -71.02 150.37 45.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.092 179.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.441 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 90.8 p -82.57 1.63 37.09 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.497 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -174.88 -166.32 0.23 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.886 0.375 . . . . 0.0 110.997 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.44 -120.62 9.31 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.806 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.492 ' O ' HG12 ' A' ' 40' ' ' ILE . 16.2 tt -94.55 -2.25 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.705 0.288 . . . . 0.0 111.49 -179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 60.97 33.46 19.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.616 -0.266 . . . . 0.0 111.115 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.2 p-80 -68.81 150.35 47.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.631 179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.576 ' CE2' HD22 ' A' ' 130' ' ' LEU . 65.7 m95 -102.12 135.02 44.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.912 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 p -154.8 153.38 27.47 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.987 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -76.6 172.88 15.4 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.73 2.287 . . . . 0.0 112.42 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.6 ' HG3' HD11 ' A' ' 34' ' ' LEU . 15.9 Cg_exo -66.11 86.58 0.25 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.617 2.211 . . . . 0.0 112.463 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.486 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 3.6 pttt -99.95 146.75 26.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.935 0.397 . . . . 0.0 110.892 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.28 -173.78 13.09 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.603 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 m80 -112.95 99.19 7.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.643 0.259 . . . . 0.0 110.72 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.719 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -67.01 130.54 32.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.048 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' HG2' ' N ' ' A' ' 52' ' ' PRO . 2.0 tt0 -96.93 151.11 37.56 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.243 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.462 ' N ' ' HG2' ' A' ' 51' ' ' GLU . 82.2 Cg_exo -39.63 -62.36 0.36 Allowed 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.818 2.345 . . . . 0.0 112.463 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.31 -19.0 63.74 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.535 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -79.96 158.92 26.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.799 0.333 . . . . 0.0 110.657 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.862 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 6.0 t70 -83.33 163.26 20.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.289 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.506 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -71.86 -64.39 0.94 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.154 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.564 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 26.5 tp -62.3 -42.88 99.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.418 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.862 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.8 OUTLIER -49.15 -45.68 44.17 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.758 0.314 . . . . 0.0 110.497 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.719 HG21 ' N ' ' A' ' 50' ' ' VAL . 84.9 m -55.81 -45.19 78.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.125 0.488 . . . . 0.0 109.889 179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.496 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.51 -28.87 65.29 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.22 178.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.976 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.6 mt -72.78 -52.46 14.9 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.056 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -57.17 -46.89 82.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.779 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.03 -33.93 69.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.03 0.443 . . . . 0.0 110.224 179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.985 HG23 HD11 ' A' ' 15' ' ' ILE . 34.0 m -60.13 -52.31 65.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.506 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.521 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -79.19 -22.89 44.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.305 179.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -78.72 -36.63 43.1 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.688 0.28 . . . . 0.0 111.207 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 4.5 mm-40 -103.21 -18.09 15.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.721 -179.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.641 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -125.04 -11.92 7.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -179.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.67 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 82.24 -10.78 52.8 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 119.85 -1.167 . . . . 0.0 112.423 -179.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.787 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -96.6 122.39 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-O 120.888 0.375 . . . . 0.0 110.758 179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 21.0 pm0 -105.64 171.53 7.28 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.088 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.976 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -49.59 -34.79 18.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.459 179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.41 -16.09 77.32 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.4 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.543 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.2 mm-40 -100.12 -10.57 21.34 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.547 0.213 . . . . 0.0 110.88 179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -127.32 -169.4 2.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.85 0.357 . . . . 0.0 110.276 179.286 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.495 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 84.9 m -135.76 100.64 4.52 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.114 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.668 HD13 ' HB2' ' A' ' 101' ' ' ALA . 11.3 mm -74.13 114.17 13.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.12 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.553 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -78.19 138.68 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 121.09 0.471 . . . . 0.0 110.826 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -95.54 149.4 21.47 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.67 -0.695 . . . . 0.0 111.0 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 105.22 -22.07 33.9 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.247 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.632 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.2 t80 -106.64 127.82 53.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.767 0.317 . . . . 0.0 111.16 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.413 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.94 127.88 6.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.271 0.558 . . . . 0.0 111.73 179.5 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -151.74 138.61 18.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.8 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -119.8 123.62 44.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.946 0.403 . . . . 0.0 111.481 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.773 HD13 ' HB3' ' A' ' 135' ' ' GLU . 9.0 mt -91.08 116.19 28.61 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.385 179.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.668 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.9 p30 -117.06 130.54 56.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.125 0.488 . . . . 0.0 110.719 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.567 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 18.4 p90 -166.86 139.24 3.52 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.795 -179.619 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.819 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 8.7 p -81.1 116.14 24.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-O 121.34 0.591 . . . . 0.0 111.259 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.786 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -73.63 -92.72 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.066 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.49 -46.08 13.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.943 0.402 . . . . 0.0 110.817 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -166.7 23.88 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.545 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.605 ' C ' HG23 ' A' ' 88' ' ' VAL . 0.2 OUTLIER -155.77 125.66 3.26 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.707 179.804 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.826 ' HG2' ' HA ' ' A' ' 7' ' ' ALA . 39.6 Cg_endo -68.37 -173.79 0.59 Allowed 'Trans proline' 0 CA--C 1.51 -0.675 0 C-N-CA 122.137 1.892 . . . . 0.0 111.649 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.919 ' CE ' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -160.56 112.53 1.94 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.353 179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.494 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 89.3 m -86.89 100.93 12.92 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 178.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.706 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 47.9 t -103.51 108.41 24.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.742 -178.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.22 123.21 39.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.733 ' HB3' HG13 ' A' ' 14' ' ' ILE . 29.8 m-85 -109.79 129.02 55.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.366 0.603 . . . . 0.0 112.579 -177.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.536 ' CD2' HD13 ' A' ' 57' ' ' LEU . 7.0 m-90 -115.16 149.59 37.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.985 179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.632 HD21 ' CE1' ' A' ' 81' ' ' PHE . 4.0 mt -82.83 121.88 27.49 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 179.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.668 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.57 135.54 48.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.868 0.366 . . . . 0.0 110.931 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.5 tt0 -113.59 117.48 31.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.71 0.29 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 6.4 m -74.79 112.81 12.63 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.148 0 CA-C-O 121.361 0.601 . . . . 0.0 110.579 179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -25.78 42.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.802 -178.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.79 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 64.0 t0 -101.06 116.41 32.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.991 0.424 . . . . 0.0 111.101 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.451 ' CD1' ' HG2' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -61.82 -42.31 98.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.105 179.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.49 21.37 9.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.874 178.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.79 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.4 p -44.57 143.05 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.243 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.401 ' HG3' ' HE ' ' A' ' 111' ' ' ARG . 2.6 pm0 -65.26 146.04 55.45 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.406 0.622 . . . . 0.0 111.221 -179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.787 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.83 98.58 5.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.293 179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.67 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 8.9 mtt-85 -96.88 105.78 17.98 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.426 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.638 HD21 ' CG2' ' A' ' 110' ' ' ILE . 9.0 mt -99.63 120.87 40.38 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.958 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -62.28 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.658 179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 19.6 p80 -87.63 19.36 3.43 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.612 0.244 . . . . 0.0 111.171 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -107.09 -43.73 4.55 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.915 0.388 . . . . 0.0 110.688 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 45.3 m80 -98.24 132.6 43.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.703 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.441 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 5.8 tp-100 -93.03 -22.48 19.12 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.647 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.92 166.88 23.38 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 111.7 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.729 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.1 p90 -139.23 174.76 10.18 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.417 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 120' ' ' ARG . 0.1 OUTLIER -160.01 158.52 30.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.147 0.499 . . . . 0.0 111.624 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.404 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 85.8 m95 -123.0 106.96 11.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.62 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.34 165.27 26.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.993 0.425 . . . . 0.0 111.457 -178.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.83 -151.22 2.54 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.364 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.498 HD21 ' CD ' ' A' ' 141' ' ' GLN . 6.9 tp -76.55 -42.8 41.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.86 0.362 . . . . 0.0 111.47 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.5 pt-20 -61.5 -52.49 64.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.83 -179.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.705 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -68.92 -45.0 71.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.97 0.414 . . . . 0.0 110.615 -179.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.83 -31.16 66.36 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.266 0.555 . . . . 0.0 109.778 178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 4.5 m -83.52 -32.33 25.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.257 178.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.5 OUTLIER -65.18 -44.49 88.32 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.8 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.576 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -76.23 -44.81 35.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.753 178.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.09 55.34 1.79 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.814 178.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.75 -34.2 0.14 Allowed 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.415 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.47 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 14.1 m-85 -55.92 118.18 4.38 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.957 -1.02 . . . . 0.0 110.678 -179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.3 ttmm -45.55 -50.91 12.57 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.52 -179.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.773 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.0 mp0 -46.6 -54.69 8.96 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.776 -179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.413 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -64.21 -45.21 89.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.118 -179.142 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -50.22 -41.7 50.33 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 179.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -70.64 -47.93 57.52 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.777 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.93 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.86 -42.75 62.88 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.138 0.494 . . . . 0.0 110.307 179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.47 -31.55 42.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.95 178.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.54 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.52 -51.19 66.57 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.596 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.556 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 1.2 mp0 -70.97 -27.63 63.86 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.936 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -59.05 -49.35 79.4 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.256 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.72 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.6 t-160 -74.3 -29.12 61.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.922 0.391 . . . . 0.0 110.624 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -67.41 -52.32 41.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.177 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -62.05 -53.14 59.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.21 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.691 HD23 HD11 ' A' ' 150' ' ' ILE . 76.6 mt -54.67 -28.34 46.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.851 -179.396 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -77.02 -10.95 59.71 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.866 0.365 . . . . 0.0 110.808 179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.46 -9.75 34.51 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.801 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.691 HD11 HD23 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -83.86 -135.86 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 179.936 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.7 -70.21 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.926 0.393 . . . . 0.0 110.733 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -175.56 -63.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.115 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.762 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.786 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.914 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.53 0 N-CA-C 110.27 -1.132 . . . . 0.0 110.27 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.914 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.36 141.56 35.54 Favored 'Trans proline' 0 N--CA 1.447 -1.233 0 C-N-CA 124.294 3.33 . . . . 0.0 109.646 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.32 166.38 0.06 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 110.831 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -162.71 94.23 0.12 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.844 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 77.9 p -148.66 16.23 0.99 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.758 0.313 . . . . 0.0 111.114 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 4.9 tmm? -87.45 117.27 26.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 110.847 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.612 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 60.13 169.7 0.08 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.701 179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.903 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -108.24 128.13 54.45 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.096 -179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.566 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -79.57 116.59 19.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.658 179.794 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.514 ' HB3' ' HD3' ' A' ' 94' ' ' LYS . . . -132.78 168.82 17.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.047 0.451 . . . . 0.0 111.619 -179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.569 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 17.7 m -156.31 123.99 5.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.261 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.516 ' HA3' ' CE1' ' A' ' 98' ' ' TYR . . . -112.93 176.71 17.75 Favored Glycine 0 CA--C 1.518 0.249 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.76 179.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.761 HD12 ' OG1' ' A' ' 64' ' ' THR . 1.2 mt -129.96 120.87 25.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 117.237 0.519 . . . . 0.0 112.322 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.65 HD11 ' CG ' ' A' ' 98' ' ' TYR . 5.7 mm -80.63 91.77 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 177.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.928 HD11 HG23 ' A' ' 64' ' ' THR . 75.7 mt -84.88 136.7 22.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.574 -177.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.708 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 45.2 p90 -150.17 131.16 14.31 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.283 -178.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.66 113.95 24.77 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.925 0.393 . . . . 0.0 110.334 178.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.742 ' NH1' HD11 ' A' ' 29' ' ' ILE . 0.0 OUTLIER -91.48 134.36 34.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.435 -179.685 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -99.95 159.0 15.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.172 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.7 tp -59.65 -83.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.106 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.707 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.8 pp -118.06 148.07 42.75 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 120.72 0.295 . . . . 0.0 111.634 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 14.7 Cg_exo -68.77 161.27 46.15 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.835 2.357 . . . . 0.0 112.285 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.46 -63.44 1.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.659 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.455 ' O ' ' CB ' ' A' ' 25' ' ' ASP . 10.8 p -98.93 -23.76 4.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.198 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.455 ' CB ' ' O ' ' A' ' 24' ' ' VAL . 6.0 m-20 89.43 34.58 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.721 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.8 t-20 -119.53 -78.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.344 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -93.43 156.32 16.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.039 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -167.51 -48.33 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.62 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.742 HD11 ' NH1' ' A' ' 18' ' ' ARG . 6.3 mt -109.63 144.14 18.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.477 0.656 . . . . 0.0 112.094 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.627 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.0 mm-40 -124.1 172.67 8.83 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 114.996 -1.002 . . . . 0.0 109.589 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 40.4 m-85 -133.46 133.94 42.91 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.688 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD23 ' CD1' ' A' ' 15' ' ' ILE . 29.8 tp -75.38 134.58 40.92 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' A' ' 119' ' ' TYR . 6.3 mt -135.06 135.43 41.26 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.082 -179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.643 HD11 ' HG3' ' A' ' 46' ' ' PRO . 38.9 mt -112.51 102.3 10.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.342 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.68 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 5.2 tm0? -61.62 134.35 56.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.171 0.51 . . . . 0.0 111.735 -179.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.0 131.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.821 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.552 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 27.0 t -84.64 9.75 12.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.672 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -157.17 -169.02 2.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.649 179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.41 -121.55 10.09 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.658 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.597 HG12 ' ND1' ' A' ' 42' ' ' HIS . 23.0 pt -100.66 9.35 8.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 63.0 50.31 3.19 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 -178.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.597 ' ND1' HG12 ' A' ' 40' ' ' ILE . 4.8 p-80 -101.2 150.55 22.85 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.841 -178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.68 ' HA ' ' HA ' ' A' ' 35' ' ' GLN . 32.9 m95 -92.84 139.68 30.29 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.147 0.499 . . . . 0.0 111.957 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.403 ' HB ' ' NZ ' ' A' ' 47' ' ' LYS . 0.6 OUTLIER -157.9 139.12 9.62 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.002 179.233 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.446 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.3 Cg_endo -66.85 175.51 5.35 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 122.232 1.955 . . . . 0.0 112.001 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.643 ' HG3' HD11 ' A' ' 34' ' ' LEU . 32.1 Cg_exo -59.4 113.01 1.42 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.762 2.308 . . . . 0.0 112.55 -179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' NZ ' ' HB ' ' A' ' 44' ' ' THR . 0.4 OUTLIER -112.5 141.44 46.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.829 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.479 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.51 167.8 21.28 Favored Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.629 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.437 ' CE1' ' HE2' ' A' ' 94' ' ' LYS . 48.8 m-70 -113.86 101.89 9.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.811 0.339 . . . . 0.0 110.706 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.59 ' N ' HG21 ' A' ' 59' ' ' THR . 0.2 OUTLIER -67.77 129.98 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.416 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.572 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -90.61 172.11 7.37 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.724 -179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 73.3 Cg_exo -50.03 -63.9 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.57 2.18 . . . . 0.0 112.733 -179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.03 10.38 58.14 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.292 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 16.7 tt0 -89.22 161.51 16.4 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 117.044 0.422 . . . . 0.0 110.912 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.898 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 8.6 t0 -86.81 162.94 17.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.763 179.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.495 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -75.15 -63.23 1.31 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.842 0.353 . . . . 0.0 111.224 -179.496 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.703 HD21 HG21 ' A' ' 77' ' ' ILE . 26.8 tp -62.75 -40.89 98.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.949 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.898 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.9 OUTLIER -50.36 -47.94 55.83 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.48 179.812 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.59 HG21 ' N ' ' A' ' 50' ' ' VAL . 24.6 m -54.19 -42.61 69.92 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.569 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.16 -37.13 75.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.825 178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.879 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.2 mt -64.8 -52.7 55.43 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.593 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.4 tpt180 -62.87 -40.32 97.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.442 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.479 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -63.17 -32.22 73.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.06 179.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.928 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -65.1 -49.46 69.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.681 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.52 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -76.92 -22.88 52.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.877 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -79.29 -33.47 43.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.853 0.359 . . . . 0.0 111.228 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -106.74 -16.63 14.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.664 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.85 -6.81 4.51 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.501 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 75.25 -5.57 33.98 Favored Glycine 0 CA--C 1.522 0.513 0 C-N-CA 119.802 -1.19 . . . . 0.0 112.77 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.693 HG23 ' HB3' ' A' ' 74' ' ' GLN . 2.8 mt -98.97 124.22 52.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.145 0 CA-C-N 117.013 0.407 . . . . 0.0 110.529 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 9.6 pt-20 -110.31 170.65 7.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.106 -179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.879 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.44 -32.51 3.32 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.828 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.6 -25.75 74.51 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.088 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.693 ' HB3' HG23 ' A' ' 70' ' ' ILE . 11.2 mm-40 -94.41 1.47 55.81 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.409 0.147 . . . . 0.0 111.146 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.852 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.39 -173.92 3.89 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.924 0.392 . . . . 0.0 110.705 178.57 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.556 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 42.4 m -135.93 98.15 3.81 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.686 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.737 HD12 HD21 ' A' ' 13' ' ' LEU . 11.5 mm -68.69 107.72 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.453 -179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.502 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -70.58 133.09 32.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 121.274 0.559 . . . . 0.0 110.715 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -90.96 150.9 21.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.212 -179.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 106.19 -25.67 22.83 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.092 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.476 ' CE1' HD21 ' A' ' 100' ' ' LEU . 21.7 t80 -102.43 119.96 39.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.8 0.333 . . . . 0.0 111.091 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.524 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -149.75 124.75 9.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.275 0.559 . . . . 0.0 110.86 179.105 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mmm180 -148.79 138.14 21.76 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.222 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.979 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.7 pm0 -118.25 121.06 39.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.034 0.445 . . . . 0.0 111.047 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.8 HD13 ' CB ' ' A' ' 135' ' ' GLU . 5.5 mt -85.09 123.45 30.63 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.35 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.416 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.2 m-80 -115.45 120.29 39.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.642 -179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 22.1 p90 -167.33 141.18 3.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.818 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.621 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.6 p -81.46 109.5 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.238 179.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.529 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -78.53 -100.68 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.039 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -38.58 89.03 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.809 0.337 . . . . 0.0 110.959 -179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 173.64 28.87 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.646 179.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.846 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -157.02 130.15 4.49 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.495 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.903 ' O ' HD12 ' A' ' 8' ' ' LEU . 41.1 Cg_endo -65.46 120.12 7.26 Favored 'Trans proline' 0 CA--C 1.512 -0.594 0 C-N-CA 123.263 2.642 . . . . 0.0 112.368 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.524 ' HD3' HG22 ' A' ' 96' ' ' VAL . 0.7 OUTLIER -103.74 127.24 51.23 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.859 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 69.5 m -100.12 105.14 16.73 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.682 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 52.8 t -105.48 107.72 23.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.933 -178.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.979 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.76 111.47 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 178.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CG ' HD11 ' A' ' 14' ' ' ILE . 7.4 m-85 -91.05 166.02 13.22 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -177.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.524 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -157.01 134.07 10.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.266 -0.879 . . . . 0.0 110.421 -179.552 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.526 HD13 ' HG ' ' A' ' 147' ' ' LEU . 1.3 mt -73.41 132.69 43.27 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.301 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.706 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -139.51 138.61 36.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.146 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.708 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 2.3 tt0 -108.85 109.52 20.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.895 179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.767 HG12 HD23 ' A' ' 75' ' ' LEU . 6.1 m -72.49 149.86 8.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 CA-C-O 121.211 0.529 . . . . 0.0 111.39 -179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 104' ' ' LYS . 0.2 OUTLIER -71.15 -8.18 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.933 -178.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.469 ' O ' HG12 ' A' ' 108' ' ' VAL . 3.2 t70 -149.47 117.88 6.49 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.165 0.507 . . . . 0.0 112.238 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.553 ' CA ' ' HG3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -49.68 -39.73 37.67 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.315 0.579 . . . . 0.0 110.365 178.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -101.54 25.0 8.91 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.877 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 105' ' ' ASP . 3.4 p -43.92 156.86 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.231 0.109 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.657 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 3.1 pm0 -60.94 139.7 57.95 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 121.274 0.559 . . . . 0.0 110.917 -179.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.807 HG21 ' CD1' ' A' ' 119' ' ' TYR . 45.8 mm -122.14 99.52 7.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 115.382 -0.827 . . . . 0.0 110.429 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.501 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 2.4 mtt180 -102.7 96.61 6.98 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.549 -0.75 . . . . 0.0 111.317 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.728 HD21 ' CG2' ' A' ' 110' ' ' ILE . 5.6 mt -86.86 149.55 24.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.834 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.8 m -88.9 -170.14 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.871 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -71.49 -5.59 34.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.603 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.0 -24.3 18.4 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 110.965 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.431 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 14.8 m80 -106.52 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.642 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.552 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 13.4 pt20 -123.72 -20.76 5.38 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -161.87 171.85 17.05 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.158 0.504 . . . . 0.0 111.857 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.807 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.1 p90 -149.43 177.73 9.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.504 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.4 mtt180 -166.6 162.91 16.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.316 0.579 . . . . 0.0 111.949 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.403 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 80.4 m95 -125.17 106.8 10.16 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.224 178.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.779 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -134.85 170.46 15.83 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.113 0.482 . . . . 0.0 111.819 -178.698 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -77.31 -152.95 5.41 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.827 179.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.471 HD21 ' CD ' ' A' ' 141' ' ' GLN . 5.7 tp -77.72 -42.93 32.61 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.69 0.281 . . . . 0.0 111.59 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.537 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.7 pt-20 -60.69 -49.69 76.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.488 -179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.779 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -69.58 -52.35 26.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.93 0.395 . . . . 0.0 110.006 179.959 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -50.56 -28.12 8.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.382 0.611 . . . . 0.0 109.68 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.431 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 1.0 OUTLIER -83.05 -38.3 22.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.013 -0.994 . . . . 0.0 109.871 178.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.608 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -58.34 -47.73 82.84 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.995 -179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.63 HD22 ' CE2' ' A' ' 43' ' ' TRP . 0.4 OUTLIER -77.16 -40.34 45.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.592 179.415 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.504 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -76.74 54.62 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.634 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.462 ' OE1' HD11 ' A' ' 40' ' ' ILE . 0.0 OUTLIER -39.34 -35.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.822 -179.621 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.509 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 6.5 m-85 -58.43 120.62 9.12 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -46.77 -48.38 20.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.241 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.8 ' CB ' HD13 ' A' ' 85' ' ' LEU . 2.1 mp0 -51.17 -53.37 35.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.486 -179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.663 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -58.62 -39.52 80.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.062 -179.057 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.584 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -56.99 -44.94 83.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.206 -0.452 . . . . 0.0 109.935 179.104 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -66.52 -46.55 75.84 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.493 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -52.52 -44.63 65.87 Favored 'General case' 0 CA--C 1.522 -0.111 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.939 179.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.663 HD12 ' O ' ' A' ' 136' ' ' MET . 0.9 OUTLIER -80.9 -26.65 36.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.222 179.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.584 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.77 -51.81 37.1 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.169 -179.723 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -74.57 -31.61 62.13 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.597 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -53.52 -48.3 60.96 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.165 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.436 ' HB2' ' HZ ' ' A' ' 31' ' ' PHE . 8.2 t-80 -74.95 -32.25 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.041 0.448 . . . . 0.0 110.579 179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 31.9 tp60 -64.85 -52.41 56.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.512 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.448 ' CE1' HD11 ' A' ' 150' ' ' ILE . 32.8 t80 -58.03 -54.16 50.04 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.262 -179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.643 HD23 HD11 ' A' ' 150' ' ' ILE . 72.5 mt -58.0 -32.17 67.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.857 -179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.16 -15.99 58.65 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.787 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.27 -19.35 20.08 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.666 -179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.643 HD11 HD23 ' A' ' 147' ' ' LEU . 1.8 mt -79.21 -132.37 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 57.6 tt0 -166.37 -64.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.747 0.308 . . . . 0.0 110.576 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -145.34 -68.95 0.29 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.972 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.893 179.797 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.529 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.488 0 N-CA-C 110.334 -1.106 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -72.33 63.88 3.58 Favored 'Trans proline' 0 N--CA 1.446 -1.278 0 C-N-CA 124.336 3.357 . . . . 0.0 109.6 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.9 mp 58.2 -176.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -60.94 163.94 18.87 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.367 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 179.06 -176.07 0.24 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.829 0.347 . . . . 0.0 110.643 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.494 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 4.2 tpt -55.87 178.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.065 179.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.604 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 72.38 168.83 0.32 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.121 0.486 . . . . 0.0 110.735 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.2 OUTLIER -102.71 132.91 48.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.643 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.592 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.65 122.64 28.88 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.319 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -135.73 165.57 25.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.752 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.676 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 57.8 m -154.41 123.22 6.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.145 0.497 . . . . 0.0 111.236 179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.409 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.41 172.41 14.27 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.535 179.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.834 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -126.65 117.17 22.21 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 117.018 0.409 . . . . 0.0 111.249 -179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.824 HD11 ' HB1' ' A' ' 139' ' ' ALA . 76.1 mt -83.95 90.84 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 177.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.862 HD11 HG23 ' A' ' 64' ' ' THR . 43.2 mt -80.71 145.45 8.99 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.77 -178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.7 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 47.6 p90 -149.84 122.14 8.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.302 -178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.795 ' HD3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -81.54 112.9 19.19 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.274 179.268 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 25.8 ttp180 -91.62 102.77 15.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.796 0.332 . . . . 0.0 111.419 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 93.1 m -85.02 159.19 20.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.353 179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.5 tp -60.56 -81.08 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.868 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.494 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.3 pp -136.97 155.13 76.44 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 120.695 0.283 . . . . 0.0 111.333 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -59.1 157.19 30.68 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.482 2.121 . . . . 0.0 111.646 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -121.24 -77.5 0.59 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.496 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 3.2 t -134.57 -38.95 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.747 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -161.37 60.77 0.28 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.044 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -150.1 115.0 5.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.277 0.561 . . . . 0.0 110.947 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -53.15 162.05 0.75 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.515 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.67 -59.15 2.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.783 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.7 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 8.4 mt -107.82 143.12 18.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.254 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.599 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 1.4 mt-10 -134.7 124.94 26.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.034 179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.7 m-85 -89.66 144.6 25.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -178.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.65 HD23 HD12 ' A' ' 15' ' ' ILE . 43.1 tp -86.1 131.13 34.33 Favored 'General case' 0 CA--C 1.522 -0.128 0 CA-C-N 116.056 -0.52 . . . . 0.0 109.777 178.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.528 HD12 ' CD1' ' A' ' 122' ' ' LEU . 6.6 mt -129.69 140.16 51.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.618 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.498 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.7 mt -119.75 103.99 9.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.806 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 49.2 tt0 -57.85 119.79 7.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.409 -179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.55 140.5 56.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.898 179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 60.0 p -90.9 15.9 10.47 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.344 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -153.14 -167.57 2.76 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.728 0.299 . . . . 0.0 110.809 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.55 -134.93 51.1 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.093 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.659 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -87.7 6.5 3.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 O-C-N 122.664 -0.315 . . . . 0.0 111.282 179.598 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 46.3 m-70 67.79 33.49 4.8 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.92 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.659 ' HB3' HD11 ' A' ' 40' ' ' ILE . 0.3 OUTLIER -69.97 172.38 7.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.605 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.594 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 48.9 m95 -108.13 110.19 21.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.844 0.355 . . . . 0.0 111.264 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.474 HG21 ' CE1' ' A' ' 42' ' ' HIS . 53.7 p -128.93 130.6 23.45 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.102 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -55.56 179.57 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.47 2.113 . . . . 0.0 112.102 179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.638 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.6 Cg_exo -54.23 99.96 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.324 0 C-N-CA 122.122 1.881 . . . . 0.0 112.093 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.546 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER -99.34 140.83 32.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.862 0.363 . . . . 0.0 110.927 179.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.33 164.55 26.56 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.381 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 62.0 t-80 -102.4 111.67 24.07 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.628 0.251 . . . . 0.0 110.582 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.592 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -86.45 134.34 27.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.447 0.641 . . . . 0.0 111.291 -179.681 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.786 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 9.0 tt0 -90.64 150.47 42.51 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.122 -179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.14 -23.37 22.22 Favored 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.761 2.307 . . . . 0.0 112.972 -178.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.786 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.66 -11.24 38.58 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 121.03 -0.605 . . . . 0.0 112.509 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -84.66 166.51 17.02 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.894 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.4 t70 -80.35 159.0 25.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.214 0.531 . . . . 0.0 110.263 179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.527 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.55 -66.39 0.63 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.734 -179.21 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.634 HD21 HG21 ' A' ' 77' ' ' ILE . 30.9 tp -63.12 -38.06 89.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.437 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.894 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.84 -50.48 45.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.708 0.289 . . . . 0.0 110.498 -179.837 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.47 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 53.9 m -54.62 -45.89 73.77 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 120.978 0.418 . . . . 0.0 109.938 179.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.676 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -66.41 -29.21 69.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.932 -0.577 . . . . 0.0 110.184 178.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.964 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.9 mt -74.6 -52.3 12.13 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.466 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.76 -43.71 90.42 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.416 179.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.05 -32.83 72.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.388 179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.862 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -61.55 -52.77 63.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.466 179.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.455 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 1.1 tt0 -75.06 -23.0 58.01 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.4 179.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -79.49 -40.05 30.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.927 0.394 . . . . 0.0 110.877 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HB3' ' CD2' ' A' ' 116' ' ' HIS . 5.5 mm-40 -104.16 1.41 30.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.095 -178.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.673 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -147.13 -12.44 0.42 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.598 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 78.87 -7.91 47.41 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 119.867 -1.159 . . . . 0.0 112.779 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.821 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.8 mt -96.32 122.49 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 120.905 0.383 . . . . 0.0 110.529 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.463 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 6.0 pt-20 -104.48 167.42 9.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.903 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.964 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.23 -35.76 8.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.526 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.08 -23.77 76.04 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.018 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.464 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 3.6 tp60 -94.96 -5.65 44.22 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.793 0.33 . . . . 0.0 111.198 179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.923 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -132.51 -170.99 2.54 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.443 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.526 ' H ' ' H ' ' A' ' 102' ' ' GLU . 35.7 m -137.75 100.86 4.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.831 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.691 HD12 HD21 ' A' ' 13' ' ' LEU . 13.3 mm -73.15 109.76 5.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.188 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.556 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -71.63 136.22 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.962 0.411 . . . . 0.0 110.427 179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -93.72 149.74 20.98 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.511 -179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.0 -15.96 54.74 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.528 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.71 ' CD2' HD11 ' A' ' 100' ' ' LEU . 18.9 t80 -104.78 135.62 45.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.76 0.315 . . . . 0.0 111.24 -179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.608 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.99 138.1 12.47 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.126 0.488 . . . . 0.0 111.437 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 142.78 5.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.347 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.846 ' HB3' HD13 ' A' ' 97' ' ' ILE . 2.5 pm0 -132.51 127.34 34.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.903 0.382 . . . . 0.0 111.176 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.024 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.3 mt -90.55 117.31 29.13 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.433 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -113.96 126.56 55.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.774 -178.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.632 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 22.3 p90 -167.71 141.58 3.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.01 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.616 HG23 ' N ' ' A' ' 92' ' ' LYS . 10.6 p -84.97 111.88 21.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.136 0.493 . . . . 0.0 110.246 179.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.668 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -71.26 -94.32 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.442 -178.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -80.0 -37.69 33.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.825 0.345 . . . . 0.0 110.704 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -177.67 26.99 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.169 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.689 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.62 122.09 2.66 Favored Pre-proline 0 CA--C 1.534 0.343 0 CA-C-O 120.899 0.381 . . . . 0.0 110.896 179.831 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.0 Cg_endo -71.68 118.21 5.53 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.223 2.615 . . . . 0.0 112.945 -179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.728 ' HD3' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -96.76 124.37 40.72 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.069 -179.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.513 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 88.7 m -94.14 110.25 21.98 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 24.5 t -109.89 107.57 23.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 C-N-CA 120.76 -0.376 . . . . 0.0 111.386 -179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.846 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.62 128.74 39.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.645 ' HB3' HG13 ' A' ' 14' ' ' ILE . 26.2 m-85 -114.07 136.39 52.97 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.168 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.608 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.5 m-90 -123.37 146.07 48.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.128 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.71 HD11 ' CD2' ' A' ' 81' ' ' PHE . 3.1 mt -78.63 125.97 30.1 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.578 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -132.67 147.71 52.34 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 120.687 0.28 . . . . 0.0 111.388 -179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.526 ' H ' ' H ' ' A' ' 76' ' ' THR . 7.5 tt0 -126.37 111.95 15.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.748 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.729 HG12 HD23 ' A' ' 75' ' ' LEU . 6.2 m -72.08 130.16 35.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.294 0.569 . . . . 0.0 110.81 -179.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.55 -23.88 67.42 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.395 -177.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.699 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 5.7 t70 -107.13 130.23 54.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.074 0.464 . . . . 0.0 112.205 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.795 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 11.2 t80 -66.67 -37.08 84.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.931 179.042 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.61 26.4 10.0 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.064 178.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.699 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.8 p -43.8 146.86 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.12 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.925 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -71.3 142.55 50.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.344 0.592 . . . . 0.0 111.252 -179.166 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.821 ' CD1' HD11 ' A' ' 70' ' ' ILE . 43.0 mm -119.64 98.72 6.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.365 179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.598 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 1.3 mtp85 -95.7 102.77 14.6 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.217 -179.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.714 HD11 ' HD1' ' A' ' 119' ' ' TYR . 11.6 mt -100.24 139.85 35.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.804 179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 71.9 p -94.89 -154.94 0.44 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.601 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.54 19.12 1.06 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 120.521 0.201 . . . . 0.0 111.249 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.85 -35.25 8.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.896 0.379 . . . . 0.0 110.776 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.451 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 81.0 m-70 -117.74 139.78 50.58 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.968 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -92.92 -16.18 25.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.247 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.42 177.35 3.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.958 0.409 . . . . 0.0 111.332 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.776 ' CD1' HG21 ' A' ' 110' ' ' ILE . 49.5 p90 -148.2 169.71 19.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.756 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.43 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.6 OUTLIER -159.18 153.48 23.89 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.159 0.504 . . . . 0.0 111.746 179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 91.0 m95 -114.49 107.08 15.04 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.387 -0.824 . . . . 0.0 109.507 178.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.24 167.55 21.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.043 0.449 . . . . 0.0 111.489 -178.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -152.56 3.73 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 111.636 179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.2 tp -76.96 -45.47 27.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.929 0.365 . . . . 0.0 110.967 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.436 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.6 pt-20 -56.99 -51.34 69.64 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.489 -179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.798 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.74 -46.74 62.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.938 0.399 . . . . 0.0 110.539 -179.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.589 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -55.66 -30.62 61.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.262 0.553 . . . . 0.0 109.635 178.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 3.1 m -84.26 -29.7 26.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.433 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.798 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.18 -42.67 88.56 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.979 0.419 . . . . 0.0 110.719 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.2 mt -77.57 -45.1 26.34 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.762 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.953 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.6 56.68 2.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.502 178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -34.23 0.15 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.157 -0.929 . . . . 0.0 112.152 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.596 ' HE1' HD11 ' A' ' 40' ' ' ILE . 10.0 m-85 -58.82 123.85 17.84 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.81 -179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.53 -54.67 7.21 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.182 0.515 . . . . 0.0 110.475 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 1.024 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -44.77 -57.88 3.44 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.918 179.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.953 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.26 -36.5 75.61 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.009 0.433 . . . . 0.0 110.575 -179.225 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.439 ' HD3' ' O ' ' A' ' 133' ' ' PHE . 0.0 OUTLIER -62.7 -37.88 88.22 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.923 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.59 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.84 -45.6 67.46 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.049 -0.978 . . . . 0.0 110.578 179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.824 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.23 -44.92 65.08 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.246 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.589 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -78.25 -29.64 48.21 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.016 178.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.59 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -62.28 -51.67 66.78 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.165 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -70.49 -30.03 66.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.716 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -52.7 -51.65 43.11 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.51 -179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 9.6 t-160 -77.34 -29.2 53.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.86 0.362 . . . . 0.0 110.659 179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.23 -52.51 54.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.008 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.597 ' CE1' HD11 ' A' ' 150' ' ' ILE . 55.3 t80 -60.6 -54.75 41.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.8 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.532 HD23 ' CD1' ' A' ' 150' ' ' ILE . 90.0 mt -54.73 -36.84 65.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.619 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 19.3 t -66.14 -13.16 59.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.063 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.97 -18.64 18.51 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.37 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.597 HD11 ' CE1' ' A' ' 146' ' ' PHE . 1.5 mt -77.66 -130.15 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 CA-C-N 116.721 -0.218 . . . . 0.0 110.516 -179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -168.95 -57.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.056 0.455 . . . . 0.0 110.435 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -151.89 -34.87 0.13 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.156 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.202 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.906 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.883 HN61 ' HG2' ' A' ' 135' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.779 ' O ' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.551 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.751 ' HG3' ' CD2' ' A' ' 49' ' ' HIS . 81.6 Cg_endo -72.42 55.03 2.47 Favored 'Trans proline' 0 N--CA 1.447 -1.212 0 C-N-CA 124.306 3.337 . . . . 0.0 109.594 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.779 HD23 ' O ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -76.13 121.4 22.78 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.066 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 168.18 143.03 3.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.703 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 13.2 m 62.6 -177.5 0.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.863 0.363 . . . . 0.0 111.309 179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -73.66 131.64 41.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.669 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.599 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.66 168.88 0.13 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.26 0.552 . . . . 0.0 111.072 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.879 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.65 139.88 41.54 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.563 179.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.695 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.37 118.18 23.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.982 -179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -129.81 165.67 21.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.977 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.491 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 11.2 m -157.79 123.94 4.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.203 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.619 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -118.2 172.91 14.62 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.182 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.775 HD12 ' OG1' ' A' ' 64' ' ' THR . 2.1 mt -125.83 117.74 24.01 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.764 0.316 . . . . 0.0 111.386 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.782 HD11 ' HB1' ' A' ' 139' ' ' ALA . 51.9 mt -85.3 91.0 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 177.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.835 HD11 HG23 ' A' ' 64' ' ' THR . 64.6 mt -79.13 139.86 17.73 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.096 -178.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.615 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.4 p90 -144.13 121.16 11.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.41 -178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.866 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -87.34 118.59 26.88 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.69 179.469 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.6 ttm-85 -92.3 113.39 25.64 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.458 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.2 m -76.4 160.15 29.83 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.4 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.646 HD23 ' H ' ' A' ' 20' ' ' LEU . 0.1 OUTLIER -60.03 -95.64 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.832 -179.684 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.587 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.1 pp -107.72 153.64 41.37 Favored Pre-proline 0 C--N 1.332 -0.159 0 CA-C-O 120.712 0.291 . . . . 0.0 111.079 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -66.73 154.16 75.46 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.607 2.205 . . . . 0.0 112.155 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.14 -82.71 0.59 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.2 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 24' ' ' VAL . 13.4 t -86.92 -7.03 10.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.53 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.1 t70 64.24 47.51 3.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.887 0.375 . . . . 0.0 110.423 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -105.53 -55.19 2.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.281 -179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -159.09 95.79 1.29 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.581 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.1 76.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.559 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.615 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.5 mt -110.89 143.17 21.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.219 0.533 . . . . 0.0 111.791 -179.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 11.7 mp0 -131.25 138.01 49.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.712 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.613 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.0 m-85 -101.38 152.23 20.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.047 0.451 . . . . 0.0 112.047 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.73 HD23 HD12 ' A' ' 15' ' ' ILE . 45.7 tp -86.72 138.51 31.57 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.96 179.24 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.3 mt -137.72 139.69 40.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.889 0.376 . . . . 0.0 111.006 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.811 HD11 ' HG3' ' A' ' 46' ' ' PRO . 10.4 mt -119.2 109.3 15.7 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.127 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 13.0 tt0 -64.78 140.78 58.9 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.075 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.11 139.16 58.67 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.169 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 15.7 p -78.71 10.55 3.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.442 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.09 -162.65 0.11 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.744 0.307 . . . . 0.0 110.404 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 70.51 -120.3 9.02 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.753 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.649 HD11 ' HB3' ' A' ' 42' ' ' HIS . 5.2 pt -101.36 8.81 8.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.69 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 61.38 41.35 13.05 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.388 0.613 . . . . 0.0 109.521 -178.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.649 ' HB3' HD11 ' A' ' 40' ' ' ILE . 9.0 p-80 -88.71 149.82 23.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.101 -179.211 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' A' ' 35' ' ' GLN . 40.1 m95 -98.63 145.1 27.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.663 -179.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.437 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.1 OUTLIER -161.62 149.61 12.33 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.656 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.538 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 38.4 Cg_endo -65.01 166.69 17.86 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.535 2.157 . . . . 0.0 111.974 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.811 ' HG3' HD11 ' A' ' 34' ' ' LEU . 18.1 Cg_exo -66.51 87.88 0.27 Allowed 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.64 2.227 . . . . 0.0 112.519 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.619 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.6 pttt -98.81 145.32 27.08 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.925 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.42 -166.04 12.02 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.879 -179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.751 ' CD2' ' HG3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER -119.51 102.49 8.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.624 0.25 . . . . 0.0 111.021 -179.664 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.742 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -76.74 122.05 30.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.898 0.38 . . . . 0.0 110.752 179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 54' ' ' GLU . 0.3 OUTLIER -78.12 172.81 8.85 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.96 -179.768 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.497 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 52.6 Cg_exo -54.62 -56.47 2.43 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.387 2.058 . . . . 0.0 112.305 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -89.08 14.3 61.01 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.974 -179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.502 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 71.0 tt0 -94.22 158.96 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.863 0.332 . . . . 0.0 110.661 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.0 t70 -79.37 159.47 27.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.121 0.486 . . . . 0.0 110.32 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -75.65 -58.87 3.02 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.347 -179.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.496 ' CD2' HG21 ' A' ' 77' ' ' ILE . 37.1 tp -65.74 -39.79 91.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.84 0.352 . . . . 0.0 110.943 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.965 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -50.45 -49.98 53.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.442 179.717 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.742 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.9 m -54.34 -42.79 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.491 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.97 -30.56 66.86 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.098 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 1.057 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.5 mt -71.16 -52.68 17.87 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.69 179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 1.3 ttp85 -60.73 -41.32 95.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.478 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.659 ' HB1' ' OE1' ' A' ' 67' ' ' GLU . . . -62.09 -31.83 72.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.026 0.441 . . . . 0.0 110.116 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.835 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -64.9 -49.9 68.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.432 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -77.43 -26.27 51.45 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.74 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -79.34 -35.9 40.28 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.822 0.344 . . . . 0.0 111.023 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.659 ' OE1' ' HB1' ' A' ' 63' ' ' ALA . 2.3 mp0 -106.75 0.92 24.53 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.733 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.722 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -148.3 -7.12 0.41 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.583 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 73.64 -4.87 26.01 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.056 -1.069 . . . . 0.0 113.121 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.8 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.5 mt -100.09 126.75 53.52 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.08 0 CA-C-N 117.214 0.507 . . . . 0.0 110.503 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.505 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 2.0 pt-20 -109.02 169.55 8.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.424 . . . . 0.0 111.722 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 1.057 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -47.86 -35.55 10.54 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.818 179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -71.19 -22.06 78.5 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.131 179.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.462 ' HB3' HG22 ' A' ' 70' ' ' ILE . 6.6 tp60 -97.31 0.85 48.72 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.494 0.187 . . . . 0.0 111.397 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.808 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.28 -176.51 4.74 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 178.117 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.602 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 65.5 m -132.45 100.48 4.99 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 111.463 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.655 HD12 HD21 ' A' ' 13' ' ' LEU . 9.7 mm -70.17 119.06 15.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.803 179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.51 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -80.59 134.38 27.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 121.148 0.499 . . . . 0.0 111.113 -179.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -93.79 150.97 19.94 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.312 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.13 -22.96 37.82 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.332 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.861 ' CE1' HD21 ' A' ' 100' ' ' LEU . 19.0 t80 -105.75 126.04 51.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.579 0.228 . . . . 0.0 110.847 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.506 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 2.2 ttpt -157.55 126.74 5.87 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.159 0.504 . . . . 0.0 111.615 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.09 139.43 22.37 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.845 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.909 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -122.29 137.81 54.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.111 0.481 . . . . 0.0 111.55 -179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.005 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.0 mt -103.75 120.7 41.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.583 179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -110.95 127.7 55.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.778 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.577 ' CG ' ' C6 ' ' A' ' 154' ' ' ATP . 26.5 p90 -166.95 141.72 4.03 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.929 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.659 HG23 ' N ' ' A' ' 92' ' ' LYS . 9.0 p -85.35 112.87 22.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.836 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.602 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -77.16 -95.04 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.525 -178.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.436 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -73.81 -37.32 64.92 Favored 'General case' 0 N--CA 1.461 0.09 0 CA-C-O 120.841 0.353 . . . . 0.0 110.712 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.436 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.0 t-20 178.21 26.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.105 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.712 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -154.01 124.4 3.4 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 0.0 111.049 179.716 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.879 ' O ' HD12 ' A' ' 8' ' ' LEU . 67.6 Cg_endo -74.2 118.91 5.57 Favored 'Trans proline' 0 CA--C 1.514 -0.49 0 C-N-CA 123.145 2.563 . . . . 0.0 112.376 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.4 ttpt -103.59 126.36 50.68 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.616 -178.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.9 m -87.62 107.29 18.54 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 18.4 t -105.52 108.31 24.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 116.266 -0.425 . . . . 0.0 112.026 -178.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.5 mm -86.24 129.51 38.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.634 ' HB3' HG13 ' A' ' 14' ' ' ILE . 9.8 m-85 -113.63 131.98 55.93 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.506 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 1.3 m-90 -119.58 140.69 50.16 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.774 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.861 HD21 ' CE1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -77.67 133.11 38.44 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.645 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.602 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -142.03 140.93 32.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.795 0.331 . . . . 0.0 111.541 -179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.557 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 8.4 tt0 -113.15 111.6 22.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.964 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.721 HG12 HD23 ' A' ' 75' ' ' LEU . 7.0 m -71.61 151.06 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 CA-C-O 121.339 0.59 . . . . 0.0 111.65 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 104' ' ' LYS . 0.1 OUTLIER -75.7 -7.6 54.75 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.927 -179.003 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.574 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 9.7 t70 -143.89 115.1 7.95 Favored 'General case' 0 C--O 1.227 -0.123 0 CA-C-O 121.154 0.502 . . . . 0.0 112.349 -179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.866 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 0.4 OUTLIER -49.35 -40.21 34.68 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.694 178.885 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -102.95 24.72 10.3 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.793 178.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.574 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.3 p -43.52 151.25 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.667 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 2.6 pm0 -61.24 138.78 58.23 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.346 0.593 . . . . 0.0 110.193 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.816 HG21 ' CG ' ' A' ' 119' ' ' TYR . 33.6 mm -121.87 98.07 5.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.295 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.583 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 21.6 mtp180 -97.1 105.64 17.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.196 -178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.613 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 13.7 mt -92.21 155.49 17.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.349 -0.842 . . . . 0.0 111.371 -179.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -100.07 -168.06 1.54 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.641 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -67.1 -18.5 65.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.442 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -84.3 -14.24 50.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.652 0.263 . . . . 0.0 111.521 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.613 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 92.7 m-70 -117.99 164.26 15.36 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.967 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -138.56 -28.05 0.84 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.715 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -156.8 158.6 37.11 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.93 0.395 . . . . 0.0 111.619 -179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.816 ' CG ' HG21 ' A' ' 110' ' ' ILE . 44.4 p90 -135.81 173.51 11.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.446 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.481 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 13.6 mtt85 -156.64 156.42 33.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.304 0.573 . . . . 0.0 111.671 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -120.49 107.17 12.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.659 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.59 170.51 15.95 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.998 0.428 . . . . 0.0 111.714 -178.413 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -80.39 -159.8 20.96 Favored Glycine 0 N--CA 1.448 -0.558 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.147 179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.526 HD21 ' CD ' ' A' ' 141' ' ' GLN . 7.4 tp -69.61 -41.32 75.86 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.709 0.29 . . . . 0.0 111.475 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.0 pt-20 -62.87 -51.06 68.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.587 -179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.673 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.42 -51.2 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.838 0.351 . . . . 0.0 110.494 -179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -51.1 -31.1 18.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.261 0.553 . . . . 0.0 109.638 178.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 7.0 m -83.39 -29.11 28.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.295 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.548 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.9 OUTLIER -66.91 -45.18 78.76 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.932 179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.548 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -75.23 -43.46 51.57 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.426 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.69 51.67 1.11 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.911 178.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.42 -33.57 0.1 Allowed 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.527 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.472 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.6 m-85 -55.79 118.54 4.66 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.329 -179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.72 -50.84 13.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.831 -178.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 1.005 ' HB3' HD13 ' A' ' 85' ' ' LEU . 17.3 mp0 -46.94 -51.02 17.96 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.63 -0.714 . . . . 0.0 112.021 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.625 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -67.4 -39.96 85.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.72 0.295 . . . . 0.0 111.139 -179.339 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.53 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -54.64 -33.98 61.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.092 179.328 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.52 -45.41 21.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.652 179.402 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.782 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.98 -48.15 64.51 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.395 179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.625 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -75.25 -26.65 59.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.245 179.107 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.53 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -68.43 -51.93 38.34 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.967 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.498 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 5.1 mp0 -69.27 -28.97 66.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.251 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.542 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -60.83 -43.29 99.41 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.719 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 7.2 t-160 -75.91 -27.75 57.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.8 tp60 -70.94 -52.47 19.71 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.355 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.71 -53.83 53.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.807 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 83.4 mt -54.77 -29.4 53.93 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.594 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -13.42 62.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.729 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -95.37 -14.79 23.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.308 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.488 HG13 ' HA ' ' A' ' 147' ' ' LEU . 1.0 OUTLIER -85.26 -134.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.329 0 N-CA-C 110.364 -0.236 . . . . 0.0 110.364 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -149.48 -59.03 0.21 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.898 0.38 . . . . 0.0 110.506 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 56.99 165.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.19 179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.907 179.998 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.602 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.229 -1.149 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -72.37 156.3 54.78 Favored 'Trans proline' 0 N--CA 1.447 -1.223 0 C-N-CA 124.307 3.338 . . . . 0.0 109.557 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mp -59.46 152.33 21.93 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.818 0.342 . . . . 0.0 110.94 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.85 39.5 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.518 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.3 m -153.57 32.17 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.644 0.259 . . . . 0.0 110.998 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 ptm -75.23 164.29 26.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.91 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.64 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 60.19 162.39 0.05 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.694 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.827 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -114.14 141.67 47.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.732 -179.765 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.863 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.5 OUTLIER -80.66 126.56 31.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.773 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.925 ' HB2' ' HE2' ' A' ' 94' ' ' LYS . . . -137.72 161.62 36.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.607 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -156.44 123.08 5.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.17 0.51 . . . . 0.0 111.288 179.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.477 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.69 176.99 17.24 Favored Glycine 0 N--CA 1.446 -0.633 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.201 178.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.803 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.7 OUTLIER -130.71 117.64 19.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.139 0.47 . . . . 0.0 111.177 179.918 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.583 HG13 ' HB3' ' A' ' 98' ' ' TYR . 39.5 mt -84.13 90.3 2.62 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.647 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.946 HD11 HG23 ' A' ' 64' ' ' THR . 83.2 mt -79.93 145.36 9.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.413 -178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.644 ' O ' ' HA ' ' A' ' 102' ' ' GLU . 47.9 p90 -152.6 127.72 9.76 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.124 -178.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.532 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.7 OUTLIER -96.76 113.69 25.27 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.692 179.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.583 ' NH2' ' HB2' ' A' ' 152' ' ' ALA . 0.6 OUTLIER -87.04 127.22 35.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.483 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.67 161.2 22.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.452 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.45 -80.93 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.435 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.418 ' H ' HG13 ' A' ' 21' ' ' ILE . 2.5 pp -119.69 150.38 50.16 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.77 0.319 . . . . 0.0 111.523 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -62.56 156.28 53.3 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.795 2.33 . . . . 0.0 112.224 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -142.62 -69.57 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.97 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.402 HG22 ' H ' ' A' ' 24' ' ' VAL . 2.8 m -84.72 -12.83 11.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.393 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 63.11 29.81 16.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.921 0.391 . . . . 0.0 110.672 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -91.27 -71.02 0.65 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.875 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -143.46 102.08 3.89 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.657 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.43 -46.09 84.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.408 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.769 HD12 ' NE2' ' A' ' 144' ' ' HIS . 4.0 mt -106.15 150.85 8.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.42 0.628 . . . . 0.0 111.713 -179.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.58 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 37.4 mm-40 -120.72 173.5 7.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.033 179.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.524 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 21.9 m-85 -141.37 128.75 21.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.598 0.237 . . . . 0.0 111.218 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.804 HD23 HD12 ' A' ' 15' ' ' ILE . 39.6 tp -73.0 140.45 47.34 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.614 HD11 ' HA ' ' A' ' 127' ' ' ALA . 8.0 mt -139.91 145.32 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.972 0.415 . . . . 0.0 111.074 -179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 112' ' ' LEU . 7.9 mt -123.77 112.22 17.07 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.238 -179.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.451 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt0 -72.09 147.78 46.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.204 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.731 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . . . -51.49 177.54 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.386 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.5 p -106.45 -18.1 14.08 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.213 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -170.14 -19.43 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -66.21 -129.07 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.8 -0.714 . . . . 0.0 113.081 -179.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.572 ' O ' HG12 ' A' ' 40' ' ' ILE . 12.2 tt -80.4 2.52 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.735 0.302 . . . . 0.0 111.35 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.731 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 2.5 m-70 62.71 30.46 16.84 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.046 0.45 . . . . 0.0 110.27 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.503 ' HB3' HG23 ' A' ' 40' ' ' ILE . 2.5 p-80 -69.06 151.33 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.315 179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.597 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 24.4 m95 -109.63 117.83 34.96 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.194 0.521 . . . . 0.0 111.499 -179.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.433 HG22 ' SD ' ' A' ' 136' ' ' MET . 70.7 p -140.86 145.3 39.04 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.195 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.41 ' HB3' ' O ' ' A' ' 13' ' ' LEU . 32.2 Cg_exo -57.7 170.71 1.79 Allowed 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 121.995 1.797 . . . . 0.0 111.452 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.558 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 53.6 Cg_exo -52.03 95.58 0.04 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.328 2.019 . . . . 0.0 112.541 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.524 ' HD2' ' OH ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER -88.55 130.08 35.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.727 179.797 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.467 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -143.78 123.72 2.11 Favored Glycine 0 N--CA 1.451 -0.367 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.612 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.688 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 7.0 p80 -67.31 120.21 13.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.718 0.294 . . . . 0.0 110.509 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.863 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -83.32 140.09 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.122 0.487 . . . . 0.0 110.918 179.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.708 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 5.6 tt0 -91.76 149.49 39.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.93 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.7 Cg_endo -55.27 -20.82 26.39 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.958 2.438 . . . . 0.0 113.355 -178.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.682 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.56 -11.68 43.6 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.619 179.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -90.56 168.56 11.72 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 121.027 0.442 . . . . 0.0 110.911 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.801 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.1 t70 -81.76 160.79 23.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.274 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.463 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.3 OUTLIER -69.21 -66.93 0.52 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.578 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD21 HG21 ' A' ' 77' ' ' ILE . 29.1 tp -62.21 -38.04 87.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.166 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.801 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -51.08 -46.82 61.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.721 -179.705 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.53 HG21 ' CA ' ' A' ' 50' ' ' VAL . 95.9 m -55.83 -46.46 78.12 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 178.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.607 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -65.4 -31.77 73.04 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.981 178.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.775 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.1 mt -72.14 -52.32 17.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.464 179.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 12.2 ttt-85 -62.41 -36.85 83.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.841 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.467 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.06 -31.65 72.97 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.946 HG23 HD11 ' A' ' 15' ' ' ILE . 24.4 m -62.51 -52.31 63.99 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.526 179.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -74.43 -24.38 59.07 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.739 179.646 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -79.6 -36.67 37.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.816 0.341 . . . . 0.0 110.597 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -110.69 10.58 22.77 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.683 -179.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -158.53 -4.63 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.597 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 67.41 2.13 18.77 Favored Glycine 0 CA--C 1.523 0.572 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.342 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.753 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.5 mt -104.28 125.75 59.04 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 117.085 0.442 . . . . 0.0 110.363 179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.5 OUTLIER -107.94 170.44 7.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.282 -179.435 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.851 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.69 -31.63 7.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.212 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.38 -26.41 74.21 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.889 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.559 ' C ' ' HD3' ' A' ' 104' ' ' LYS . 1.2 mm-40 -96.25 2.17 52.7 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -140.79 -179.15 5.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.047 0.451 . . . . 0.0 110.465 178.498 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.523 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.1 m -131.59 100.1 5.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.124 -179.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.719 HD12 HD21 ' A' ' 13' ' ' LEU . 11.1 mm -71.1 112.29 5.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.022 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.572 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -74.18 134.07 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.026 -179.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -93.16 150.93 20.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.23 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.75 -21.74 39.53 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.951 -0.643 . . . . 0.0 112.16 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.683 ' CD1' HD21 ' A' ' 100' ' ' LEU . 21.1 t80 -104.41 123.49 47.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 110.607 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -157.47 128.69 6.74 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.276 0.56 . . . . 0.0 111.663 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.46 ' HE ' ' HA ' ' A' ' 139' ' ' ALA . 0.0 OUTLIER -158.38 142.71 15.87 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.415 179.255 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.836 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -120.07 133.18 55.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.073 0.464 . . . . 0.0 111.93 -179.343 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.949 HD13 ' HB2' ' A' ' 135' ' ' GLU . 13.5 mt -97.53 116.19 29.27 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.731 179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.621 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.2 p30 -115.53 133.34 56.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.274 0.559 . . . . 0.0 111.506 -179.069 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.628 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 7.2 p90 -166.74 140.07 3.81 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.64 179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.671 HG23 ' N ' ' A' ' 92' ' ' LYS . 8.9 p -81.26 107.19 13.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.338 0.59 . . . . 0.0 110.361 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.546 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -75.32 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.777 -178.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.0 57.37 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.309 . . . . 0.0 110.992 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 171.84 29.19 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.684 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.796 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.1 tptt -158.84 123.63 2.23 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.269 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.827 ' O ' HD12 ' A' ' 8' ' ' LEU . 33.3 Cg_endo -67.9 121.1 8.1 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.988 2.459 . . . . 0.0 113.245 -178.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.925 ' HE2' ' HB2' ' A' ' 10' ' ' ALA . 0.0 OUTLIER -94.87 113.62 25.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.806 -179.487 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.433 ' O ' ' N ' ' A' ' 10' ' ' ALA . 88.3 m -87.76 105.5 17.43 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 177.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.693 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 39.5 t -108.03 108.38 25.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.836 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.13 122.54 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 177.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.583 ' HB3' HG13 ' A' ' 14' ' ' ILE . 40.4 m-85 -102.92 147.16 27.27 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.271 0.558 . . . . 0.0 112.307 -177.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.553 ' CD2' HD13 ' A' ' 57' ' ' LEU . 1.1 m-90 -135.07 138.39 43.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.347 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.683 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.7 OUTLIER -74.55 135.43 42.12 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.523 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -139.75 139.11 36.4 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-O 120.777 0.322 . . . . 0.0 111.796 -179.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.644 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 13.3 tt0 -113.09 107.94 16.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.256 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.67 HG12 HD23 ' A' ' 75' ' ' LEU . 9.0 m -72.1 139.76 19.19 Favored 'Isoleucine or valine' 0 C--O 1.232 0.152 0 CA-C-O 121.329 0.585 . . . . 0.0 111.574 -179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.559 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 2.7 mptp? -69.25 -18.22 63.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.511 -178.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.669 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 18.8 t0 -124.25 127.77 48.18 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.532 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 9.2 t80 -60.65 -45.09 95.44 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.984 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -98.02 23.9 7.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.074 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.1 p -42.26 143.75 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.136 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.1 OUTLIER -61.05 142.09 56.9 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.303 0.573 . . . . 0.0 111.144 -178.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.753 ' CD1' HD11 ' A' ' 70' ' ' ILE . 28.7 mm -124.55 96.46 3.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.157 -0.929 . . . . 0.0 111.093 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.597 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 1.4 mtt180 -98.88 102.53 14.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.666 -179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.499 HD21 ' CG2' ' A' ' 110' ' ' ILE . 11.0 mt -88.61 -178.59 5.85 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.508 -179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.6 m -127.45 -168.13 1.84 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.275 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.43 -13.42 62.01 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.578 0.214 . . . . 0.0 111.578 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -86.84 -18.88 29.91 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.35 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.439 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 98.5 m-70 -131.04 123.36 28.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.483 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.95 0.5 32.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.115 -179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -171.16 160.2 6.23 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.937 0.399 . . . . 0.0 111.612 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.747 ' CG ' HG21 ' A' ' 110' ' ' ILE . 38.7 p90 -142.03 174.36 10.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.744 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.404 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 15.4 mtt180 -159.46 159.69 33.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.262 0.553 . . . . 0.0 111.784 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.402 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 83.3 m95 -121.45 107.26 12.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.787 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -141.09 168.33 20.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.919 0.39 . . . . 0.0 111.829 -178.639 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.48 -151.77 4.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.904 -0.665 . . . . 0.0 111.908 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 141' ' ' GLN . 15.5 tp -76.91 -49.06 16.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.778 0.323 . . . . 0.0 111.151 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -52.53 -52.09 56.43 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.614 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.818 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -69.57 -51.25 37.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.079 0.466 . . . . 0.0 110.436 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.614 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.93 -29.28 19.58 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.2 0.524 . . . . 0.0 110.032 178.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 6.7 m -84.36 -33.86 23.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.49 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.818 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.67 -42.9 95.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.954 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.62 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -78.15 -44.69 25.24 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.185 179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 137' ' ' LYS . . . -76.78 55.69 1.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.097 0.475 . . . . 0.0 109.934 178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.66 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.379 -179.215 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.511 ' CZ ' " O2'" ' A' ' 154' ' ' ATP . 45.8 m-85 -57.98 119.21 6.35 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.538 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.06 -46.75 33.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.735 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.949 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER -51.18 -51.25 55.59 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.891 -179.461 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.477 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.74 -41.34 98.06 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 110.188 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -55.9 -35.28 66.39 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.75 178.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.05 -44.65 25.8 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.171 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.506 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.83 -53.28 50.82 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.363 179.464 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -69.91 -27.17 64.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.086 179.033 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.522 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -63.22 -51.95 64.19 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.016 -179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -74.64 -27.0 60.25 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.539 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -53.92 -47.1 67.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.203 179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.769 ' NE2' HD12 ' A' ' 29' ' ' ILE . 2.9 t-160 -78.81 -34.04 45.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.001 0.429 . . . . 0.0 110.611 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -62.31 -52.3 64.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.91 -0.587 . . . . 0.0 111.247 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.513 ' CD1' HD11 ' A' ' 150' ' ' ILE . 28.7 t80 -60.66 -52.61 64.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.133 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 143' ' ' GLY . 93.1 mt -55.85 -31.88 63.14 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.483 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -75.66 -14.63 60.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.615 179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.75 -12.24 27.53 Favored 'General case' 0 CA--C 1.528 0.104 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.515 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.516 HD11 HD23 ' A' ' 147' ' ' LEU . 1.1 mt -82.85 -131.34 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 -179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.93 -64.59 1.26 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.82 0.343 . . . . 0.0 111.131 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.583 ' HB2' ' NH2' ' A' ' 18' ' ' ARG . . . 64.01 114.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.126 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.81 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.71 HN61 ' CD ' ' A' ' 135' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.924 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.538 0 N-CA-C 110.29 -1.124 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.924 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 83.1 Cg_endo -72.32 88.31 0.86 Allowed 'Trans proline' 0 N--CA 1.447 -1.237 0 C-N-CA 124.315 3.343 . . . . 0.0 109.614 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mt 59.68 87.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.024 0.44 . . . . 0.0 110.774 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.49 33.96 0.68 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.405 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.41 106.37 2.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.887 0.375 . . . . 0.0 110.875 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.445 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 1.2 tmm? -89.22 127.54 35.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.986 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.624 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 68.42 170.37 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 111.704 179.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.912 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -105.53 134.24 48.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.367 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.724 ' HB3' HG13 ' A' ' 50' ' ' VAL . 1.4 ttm-85 -80.31 118.24 21.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.724 179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.538 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -134.65 166.88 21.89 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.659 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.561 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 7.7 m -157.04 123.78 5.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.053 0.454 . . . . 0.0 111.103 179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.563 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -114.05 176.44 17.08 Favored Glycine 0 N--CA 1.447 -0.622 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.857 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -131.01 117.72 19.58 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.245 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.879 HD11 ' HB1' ' A' ' 139' ' ' ALA . 70.2 mt -82.92 90.88 2.38 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 177.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.748 HD11 HG23 ' A' ' 64' ' ' THR . 20.1 mt -80.9 145.44 8.95 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.265 -178.622 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.728 ' HB2' HG23 ' A' ' 29' ' ' ILE . 50.1 p90 -154.32 122.65 6.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.826 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.438 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -75.28 115.67 15.17 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.948 0.404 . . . . 0.0 110.729 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 -106.68 118.05 35.65 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.236 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.3 160.04 31.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.373 179.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.5 tp -55.7 -80.8 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.658 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.405 ' H ' HG13 ' A' ' 21' ' ' ILE . 1.8 pp -115.34 145.42 34.28 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.82 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 2.7 Cg_exo -75.68 157.67 39.83 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.768 2.312 . . . . 0.0 112.683 -179.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -71.95 0.72 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.431 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.479 ' O ' HG12 ' A' ' 24' ' ' VAL . 11.1 t -104.89 5.71 10.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.862 179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.9 t0 67.99 21.85 8.72 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.006 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -93.62 -83.56 0.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.868 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -94.92 124.19 38.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.635 -0.257 . . . . 0.0 110.36 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.98 -46.37 0.48 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.31 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.728 HG23 ' HB2' ' A' ' 16' ' ' PHE . 9.1 mt -108.26 138.36 35.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.046 0.451 . . . . 0.0 111.873 -179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.64 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 60.0 mt-10 -134.19 119.44 18.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.973 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.639 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 58.9 m-85 -82.66 149.19 27.51 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.617 HD23 ' CD1' ' A' ' 15' ' ' ILE . 38.9 tp -88.45 135.49 33.45 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.584 -0.735 . . . . 0.0 109.719 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.51 HD11 ' HA ' ' A' ' 127' ' ' ALA . 9.3 mt -135.82 141.54 44.72 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.808 0.337 . . . . 0.0 110.701 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.687 HD22 HD22 ' A' ' 112' ' ' LEU . 19.4 mt -119.64 112.77 19.73 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.97 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.464 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 4.5 tt0 -74.35 138.49 43.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.197 -179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.88 145.67 55.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.139 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.484 ' CB ' ' HB2' ' A' ' 117' ' ' GLN . 96.4 p -75.26 1.64 13.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.704 -0.226 . . . . 0.0 111.598 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -170.72 -161.14 0.22 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.665 0.269 . . . . 0.0 111.083 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.01 -128.54 40.06 Favored Glycine 0 C--N 1.333 0.369 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.779 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 40' ' ' ILE . 11.2 tt -85.53 -6.93 10.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.764 0.316 . . . . 0.0 111.239 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 65.67 33.6 8.26 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.868 179.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -66.27 149.14 50.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.924 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.666 ' CE2' HD22 ' A' ' 130' ' ' LEU . 24.9 m95 -106.03 119.48 39.31 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.533 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -143.49 141.79 19.77 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.133 179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.63 158.44 8.11 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.719 2.28 . . . . 0.0 112.405 179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.505 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 44.1 Cg_endo -66.62 101.28 0.54 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.723 2.282 . . . . 0.0 112.199 179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.553 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -100.14 153.04 19.57 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.054 0.454 . . . . 0.0 111.561 -179.845 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.496 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -129.13 164.19 22.23 Favored Glycine 0 N--CA 1.452 -0.258 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.273 179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.474 ' CE1' ' HB3' ' A' ' 8' ' ' LEU . 1.1 t-80 -96.54 102.85 14.71 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.645 0.26 . . . . 0.0 110.88 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.724 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.3 p -71.26 130.72 35.03 Favored 'Isoleucine or valine' 0 C--O 1.232 0.183 0 CA-C-O 121.08 0.466 . . . . 0.0 111.149 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -89.92 174.69 4.48 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.748 -179.738 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.533 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 51.3 Cg_exo -56.0 -60.52 0.49 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.292 1.995 . . . . 0.0 112.462 -179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.92 7.28 63.35 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.928 -0.653 . . . . 0.0 113.471 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.424 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 41.6 tt0 -88.9 164.88 14.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.984 0.421 . . . . 0.0 110.809 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.856 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -88.39 159.81 17.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.152 0.501 . . . . 0.0 110.631 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.419 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -71.66 -62.77 1.29 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.87 -179.983 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.742 HD21 HG21 ' A' ' 77' ' ' ILE . 29.7 tp -64.43 -40.8 96.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.481 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.856 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.03 -46.4 52.92 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 120.589 0.233 . . . . 0.0 110.393 -179.499 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.49 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 44.6 m -55.89 -46.73 78.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.563 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -66.79 -27.92 67.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.465 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.642 ' HG ' ' O ' ' A' ' 57' ' ' LEU . 93.3 mt -77.06 -52.13 9.86 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.686 179.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.62 -36.37 80.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.051 179.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.496 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -67.36 -33.76 75.91 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.202 0.525 . . . . 0.0 109.649 179.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.748 HG23 HD11 ' A' ' 15' ' ' ILE . 98.6 m -61.22 -55.79 28.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.588 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.5 OUTLIER -68.21 -20.67 64.85 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.883 179.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -79.21 -45.58 19.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.908 0.385 . . . . 0.0 110.876 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 3.2 mp0 -104.96 9.87 34.39 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.628 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -149.75 -9.36 0.3 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.441 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 69.93 0.94 29.76 Favored Glycine 0 CA--C 1.52 0.365 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.01 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.634 HD13 HG11 ' A' ' 103' ' ' VAL . 1.3 mt -106.3 130.81 57.41 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 117.087 0.444 . . . . 0.0 110.913 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -113.24 172.85 6.7 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.95 -30.01 32.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.869 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -72.99 -10.84 78.35 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.162 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 8.4 mm100 -112.74 -14.46 13.11 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 111.561 0.208 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.1 -178.69 3.93 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.281 179.13 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.564 ' H ' ' H ' ' A' ' 102' ' ' GLU . 9.6 m -124.31 101.71 7.32 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.581 -179.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.742 HG21 HD21 ' A' ' 57' ' ' LEU . 11.7 mm -78.0 123.59 35.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.69 179.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.553 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -87.97 136.88 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.095 0.474 . . . . 0.0 111.372 -179.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -94.54 151.29 19.46 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.939 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.34 -26.7 22.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.281 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.606 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.9 t80 -98.83 132.62 44.04 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.872 0.368 . . . . 0.0 110.835 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.542 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -158.26 133.59 8.73 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.187 0.517 . . . . 0.0 111.388 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -160.21 143.13 13.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.739 179.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.872 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -129.65 128.53 42.79 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.932 0.396 . . . . 0.0 111.118 -179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.971 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.4 mt -89.99 118.25 29.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.222 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.502 HD22 ' HA ' ' A' ' 95' ' ' THR . 2.2 m120 -111.07 124.46 52.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.502 -178.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.595 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 16.6 p90 -167.7 141.34 3.45 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.257 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.589 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.3 p -83.89 111.22 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.369 179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.677 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -79.01 -102.23 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.796 -178.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -64.07 -35.65 81.43 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.77 0.319 . . . . 0.0 111.01 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 2.6 p-10 173.19 30.72 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.856 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.847 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.92 126.09 2.63 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.78 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.912 ' O ' HD12 ' A' ' 8' ' ' LEU . 59.3 Cg_endo -72.43 119.28 6.03 Favored 'Trans proline' 0 CA--C 1.512 -0.601 0 C-N-CA 123.136 2.557 . . . . 0.0 112.455 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.538 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -100.49 130.2 46.54 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.528 -178.586 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.502 ' HA ' HD22 ' A' ' 86' ' ' ASN . 96.1 m -97.03 101.53 13.12 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 178.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.72 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 40.2 t -103.33 108.33 24.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.784 -178.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.872 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.66 122.74 39.15 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.665 ' HB3' HG13 ' A' ' 14' ' ' ILE . 25.3 m-85 -110.66 128.18 55.59 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.184 0.516 . . . . 0.0 112.001 -178.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.618 ' CD2' HD13 ' A' ' 57' ' ' LEU . 10.9 m-90 -108.06 169.31 8.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.766 178.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.608 HD13 ' HG ' ' A' ' 147' ' ' LEU . 2.2 mt -101.52 109.06 20.8 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.621 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -118.75 151.73 37.48 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.093 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.564 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.9 tm-20 -131.3 115.16 15.93 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.12 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.636 HG12 HD23 ' A' ' 75' ' ' LEU . 6.0 m -71.97 131.44 34.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.291 0.567 . . . . 0.0 110.632 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 74' ' ' GLN . 4.7 mttt -67.81 -26.04 65.88 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.694 -0.684 . . . . 0.0 112.178 -178.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.755 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 58.4 t0 -104.16 125.14 50.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.951 0.405 . . . . 0.0 112.047 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -62.24 -42.84 99.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.892 179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -98.9 23.2 9.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.743 178.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.755 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.5 p -43.49 148.08 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.326 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.604 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -62.95 140.98 58.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.31 0.576 . . . . 0.0 111.745 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.81 HG21 ' CD1' ' A' ' 119' ' ' TYR . 33.0 mm -124.23 96.75 4.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.24 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.692 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -99.42 101.43 12.69 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.855 -178.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.719 HD11 ' HD1' ' A' ' 119' ' ' TYR . 9.2 mt -97.09 125.04 41.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.297 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.6 p -65.25 -164.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.422 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -80.29 13.96 2.16 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.676 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -104.54 -35.4 7.87 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 121.015 0.436 . . . . 0.0 110.68 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.528 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 42.0 m80 -107.25 123.32 48.13 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.608 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.484 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 6.1 tp60 -92.5 -13.41 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.586 -179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -164.23 167.67 19.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.107 0.48 . . . . 0.0 111.761 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.81 ' CD1' HG21 ' A' ' 110' ' ' ILE . 40.8 p90 -146.63 168.54 21.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.512 -179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.433 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 18.8 mtt180 -156.08 156.55 34.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.136 0.493 . . . . 0.0 111.553 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.506 ' CE2' HD13 ' A' ' 32' ' ' LEU . 89.1 m95 -119.66 107.52 13.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.592 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.17 167.73 21.42 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.856 0.36 . . . . 0.0 111.601 -178.451 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.62 -162.2 11.17 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.702 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.43 ' O ' ' HB3' ' A' ' 128' ' ' CYS . 8.3 tp -67.92 -45.58 73.94 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.809 0.305 . . . . 0.0 111.048 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.429 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.4 pt-20 -55.14 -53.39 56.49 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.556 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.721 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.1 OUTLIER -68.81 -51.89 35.95 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.018 0.437 . . . . 0.0 109.84 179.659 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -51.25 -27.46 9.26 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.126 0.489 . . . . 0.0 109.782 178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 124' ' ' LEU . 0.2 OUTLIER -83.0 -33.25 26.59 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.742 178.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.636 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.3 OUTLIER -64.7 -45.83 84.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.788 -179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.666 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.2 mt -77.4 -36.98 52.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.199 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.82 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.67 49.66 1.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.648 179.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.77 -30.45 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.066 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.525 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 19.6 m-85 -65.0 127.19 30.59 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.58 -56.59 9.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.191 -0.459 . . . . 0.0 112.001 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.971 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.77 -50.17 26.43 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.984 0.364 . . . . 0.0 111.984 -179.089 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.82 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.36 -36.51 75.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.935 0.398 . . . . 0.0 110.497 -179.433 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.3 OUTLIER -62.13 -32.61 73.22 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 178.773 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.563 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.09 -46.3 35.54 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.011 -0.995 . . . . 0.0 110.699 179.081 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.879 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.65 -44.66 66.28 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 121.052 0.454 . . . . 0.0 110.527 179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -79.72 -24.83 41.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.435 178.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.563 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.06 -52.11 46.21 Favored 'General case' 0 C--O 1.231 0.103 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.523 -179.469 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -72.66 -30.85 64.63 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.712 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.44 -47.27 84.59 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.448 -0.882 . . . . 0.0 111.742 179.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.523 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.3 OUTLIER -75.0 -35.11 62.02 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.085 0.469 . . . . 0.0 110.17 179.296 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -65.09 -52.94 52.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.686 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -63.89 -53.78 45.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 111.159 -179.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.75 HD23 HD11 ' A' ' 150' ' ' ILE . 94.9 mt -55.86 -28.54 57.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.737 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 41.2 t -73.72 -8.37 55.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.522 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.85 -6.24 21.57 Favored 'General case' 0 CA--C 1.53 0.197 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.75 HD11 HD23 ' A' ' 147' ' ' LEU . 0.0 OUTLIER -95.0 -141.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.677 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.462 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 2.6 mm-40 -137.1 -69.1 0.47 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.785 0.326 . . . . 0.0 110.927 -179.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -146.77 -40.52 0.2 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.191 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.778 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.677 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.525 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -72.37 85.64 1.06 Allowed 'Trans proline' 0 N--CA 1.447 -1.255 0 C-N-CA 124.336 3.357 . . . . 0.0 109.586 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.04 130.53 46.83 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-O 120.86 0.362 . . . . 0.0 110.958 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 110.88 55.85 0.51 Allowed Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.394 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.6 p -144.97 -100.49 0.1 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.616 0.246 . . . . 0.0 111.046 -179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.442 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 8.4 ttp -75.15 165.53 25.07 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 120.86 0.362 . . . . 0.0 110.637 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.62 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 69.16 163.94 0.24 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.833 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -111.88 133.99 53.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.178 -179.63 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.687 ' HB3' HG13 ' A' ' 50' ' ' VAL . 3.6 ttt-85 -79.53 119.85 23.09 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.476 179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.471 ' HB2' ' CG ' ' A' ' 94' ' ' LYS . . . -132.49 163.46 28.76 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.109 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.511 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 46.1 m -156.24 123.85 5.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.056 179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.58 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.64 174.06 15.07 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.75 179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.725 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.9 OUTLIER -124.95 118.15 25.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.126 0.463 . . . . 0.0 111.872 -179.229 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.909 HD11 ' HB1' ' A' ' 139' ' ' ALA . 52.3 mt -82.44 91.68 2.37 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.952 HD11 HG23 ' A' ' 64' ' ' THR . 25.8 mt -83.75 146.46 6.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.537 -0.756 . . . . 0.0 112.1 -178.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.657 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.45 122.68 7.16 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.276 -0.875 . . . . 0.0 111.657 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.546 ' CZ ' ' HG3' ' A' ' 30' ' ' GLU . 1.2 ppt_? -83.29 112.86 20.27 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.014 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.471 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 5.3 ttp180 -94.32 114.96 27.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.401 -179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -96.33 152.43 18.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.705 179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.7 tp -60.74 -80.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.757 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.42 ' H ' HG13 ' A' ' 21' ' ' ILE . 2.7 pp -113.38 152.32 45.13 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 120.761 0.315 . . . . 0.0 111.267 179.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -63.05 150.53 88.38 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.39 2.06 . . . . 0.0 111.977 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.805 ' HB2' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -90.46 -72.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.383 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.4 m -133.67 -40.98 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -171.28 43.07 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.951 0.405 . . . . 0.0 111.38 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.805 HD21 ' HB2' ' A' ' 23' ' ' LYS . 1.6 p30 -124.87 121.45 34.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.966 179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -42.36 153.46 0.07 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.557 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.4 -34.5 76.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.947 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.657 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 5.7 mt -116.09 137.28 50.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.178 0.513 . . . . 0.0 111.866 -179.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.606 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.5 OUTLIER -136.12 126.81 27.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.468 179.196 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.5 m-85 -86.75 147.41 25.86 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -177.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.587 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 42.5 tp -84.04 133.08 34.68 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.676 178.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.7 mt -134.32 137.25 44.07 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.951 0.405 . . . . 0.0 110.815 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.704 HD11 ' HG3' ' A' ' 46' ' ' PRO . 2.2 mt -120.73 105.09 10.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.634 -179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 1.7 tt0 -59.49 132.77 55.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.212 -179.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 42' ' ' HIS . . . -58.65 135.54 57.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.42 179.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.468 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 19.0 p -80.95 10.77 4.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.497 -179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -164.98 -173.31 2.88 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.728 0.299 . . . . 0.0 110.438 179.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.95 -131.9 36.67 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.373 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -88.69 6.14 3.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.693 0.282 . . . . 0.0 111.462 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 58.03 44.56 19.28 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.807 179.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.665 ' HB3' HD11 ' A' ' 40' ' ' ILE . 6.9 p80 -67.93 174.42 3.74 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.185 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 81.0 m95 -120.2 101.99 8.2 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.055 -0.521 . . . . 0.0 109.638 179.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.454 HG23 ' ND1' ' A' ' 42' ' ' HIS . 71.5 p -126.37 154.32 74.85 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.563 -179.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.548 ' HG2' ' CE1' ' A' ' 98' ' ' TYR . 63.4 Cg_endo -70.27 173.88 10.77 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.408 2.072 . . . . 0.0 111.969 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.704 ' HG3' HD11 ' A' ' 34' ' ' LEU . 21.9 Cg_exo -63.93 86.93 0.15 Allowed 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.517 2.145 . . . . 0.0 112.082 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.58 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 1.2 pttt -96.21 152.26 18.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.884 0.373 . . . . 0.0 111.054 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -139.14 -177.87 15.88 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.889 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.469 ' CD2' ' HD2' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -107.0 115.92 31.02 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.67 0.271 . . . . 0.0 110.504 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.687 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -90.42 128.84 42.07 Favored 'Isoleucine or valine' 0 C--O 1.232 0.181 0 CA-C-O 121.241 0.543 . . . . 0.0 111.179 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 3.0 tt0 -92.06 153.51 43.3 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.799 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.598 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 5.2 Cg_endo -47.7 -43.21 29.06 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 122.968 2.445 . . . . 0.0 112.432 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.425 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -80.43 -15.21 78.77 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.431 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -83.53 164.42 19.82 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.798 0.332 . . . . 0.0 111.258 -179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.865 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 12.0 t70 -85.22 161.44 19.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.937 0.399 . . . . 0.0 110.473 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.549 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 1.7 m-20 -72.64 -64.76 0.89 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.606 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.708 HD21 HG21 ' A' ' 77' ' ' ILE . 28.4 tp -63.43 -41.6 98.69 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.74 -0.209 . . . . 0.0 110.927 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.865 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.1 OUTLIER -49.86 -46.3 51.3 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.419 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.512 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.1 m -55.8 -44.87 78.22 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.511 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -68.5 -30.06 68.81 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.927 178.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.776 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.7 mt -73.14 -52.42 14.25 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.26 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -40.1 84.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.327 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.58 -34.04 76.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.261 0.553 . . . . 0.0 109.806 179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.952 HG23 HD11 ' A' ' 15' ' ' ILE . 39.6 m -59.12 -52.62 64.92 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.588 179.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.561 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.8 pt20 -74.59 -23.13 58.7 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.838 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -78.2 -35.45 48.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.899 0.38 . . . . 0.0 110.812 179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.494 ' HB3' HD13 ' A' ' 34' ' ' LEU . 5.5 mt-10 -109.8 3.05 20.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.868 -179.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -150.73 -6.97 0.28 Allowed 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 70.63 2.38 43.47 Favored Glycine 0 CA--C 1.518 0.264 0 C-N-CA 120.071 -1.061 . . . . 0.0 112.618 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.749 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -105.85 128.16 60.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-O 120.878 0.371 . . . . 0.0 110.301 179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.516 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 4.4 pm0 -112.19 172.23 7.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.482 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.823 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -52.67 -31.97 39.91 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.999 179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -75.79 -6.42 81.76 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.175 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.63 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -112.88 -14.36 13.05 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 120.548 0.213 . . . . 0.0 110.968 179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.823 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -122.86 -171.07 2.21 Favored 'General case' 0 N--CA 1.461 0.114 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 178.698 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.548 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.6 m -130.91 98.78 4.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.251 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.708 HG21 HD21 ' A' ' 57' ' ' LEU . 12.3 mm -73.22 122.27 25.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.037 179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.693 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -85.28 135.58 24.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.741 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -92.97 151.43 19.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.267 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 97.71 -23.18 37.09 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.524 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.702 ' CD1' HD21 ' A' ' 100' ' ' LEU . 19.8 t80 -102.13 126.11 49.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.841 0.353 . . . . 0.0 110.917 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.468 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.2 ttpt -158.1 125.18 4.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.191 0.52 . . . . 0.0 111.306 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.9 137.54 23.76 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.612 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.827 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.08 127.5 51.72 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.991 0.424 . . . . 0.0 111.496 -179.5 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.976 HD13 ' HB2' ' A' ' 135' ' ' GLU . 6.7 mt -92.73 117.34 29.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.225 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.629 HD21 HG23 ' A' ' 95' ' ' THR . 2.0 m-80 -107.02 123.76 48.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.3 -178.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.645 ' HB2' ' C2 ' ' A' ' 154' ' ' ATP . 25.5 p90 -166.88 143.48 4.59 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.16 -179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.592 HG23 ' N ' ' A' ' 92' ' ' LYS . 11.0 p -84.31 111.42 20.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.541 179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.616 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -76.4 -106.15 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.241 -179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.12 -41.55 88.47 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.927 0.394 . . . . 0.0 110.763 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 10.7 p30 177.9 29.52 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.732 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.791 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -155.48 125.84 3.38 Favored Pre-proline 0 N--CA 1.452 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.562 179.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.859 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.9 Cg_endo -70.53 119.99 6.77 Favored 'Trans proline' 0 CA--C 1.513 -0.544 0 C-N-CA 123.179 2.586 . . . . 0.0 112.481 -179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.471 ' CG ' ' HB2' ' A' ' 10' ' ' ALA . 6.0 ttpt -106.89 119.02 38.24 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.96 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.629 HG23 HD21 ' A' ' 86' ' ' ASN . 47.7 m -82.19 107.74 15.12 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.735 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 46.3 t -104.28 107.97 23.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.914 -178.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.827 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.47 131.36 34.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 177.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.657 ' HB3' HG13 ' A' ' 14' ' ' ILE . 6.1 m-85 -116.24 136.74 52.74 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.287 0.565 . . . . 0.0 112.135 -177.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.549 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 8.9 m-90 -125.01 140.91 52.49 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.238 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.702 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.5 OUTLIER -74.76 132.21 41.42 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.709 -0.396 . . . . 0.0 109.936 179.171 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.59 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -141.15 135.75 31.16 Favored 'General case' 0 C--O 1.224 -0.247 0 CA-C-O 120.821 0.343 . . . . 0.0 111.549 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.587 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.8 tm-20 -113.55 115.8 28.53 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.257 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.763 HG12 HD23 ' A' ' 75' ' ' LEU . 16.3 m -71.89 122.25 23.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.165 0 CA-C-O 121.159 0.504 . . . . 0.0 110.447 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -64.05 -22.34 66.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.661 -178.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.912 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -100.91 111.46 23.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.27 0.557 . . . . 0.0 111.711 -178.942 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -56.69 -39.14 73.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.65 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -105.76 28.07 7.86 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.551 179.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.912 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.3 p -48.18 149.08 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.054 -0.976 . . . . 0.0 111.699 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.438 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 2.1 pm0 -72.24 144.0 48.6 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.201 0.524 . . . . 0.0 110.577 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.774 HG21 ' CG ' ' A' ' 119' ' ' TYR . 37.6 mm -121.66 94.59 3.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.659 179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.473 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.3 OUTLIER -97.59 98.61 10.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.983 -1.008 . . . . 0.0 110.715 -179.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.686 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.0 mt -83.09 174.64 10.66 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.717 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.401 ' OG ' ' HG2' ' A' ' 115' ' ' GLU . 24.7 p -116.18 -167.72 1.32 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.832 179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -59.94 -43.48 94.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.997 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.401 ' HG2' ' OG ' ' A' ' 113' ' ' SER . 0.1 OUTLIER -69.37 -4.52 18.68 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 -179.495 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.474 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 40.1 m-70 -120.99 144.45 48.5 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 121.051 0.453 . . . . 0.0 111.314 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.468 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 2.4 pt20 -127.53 -18.12 4.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.628 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -162.72 154.89 18.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.939 0.399 . . . . 0.0 111.421 -179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.774 ' CG ' HG21 ' A' ' 110' ' ' ILE . 37.8 p90 -136.65 168.15 20.05 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.41 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 119' ' ' TYR . 6.7 mtt180 -156.19 159.85 39.33 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 121.134 0.492 . . . . 0.0 111.598 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.469 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 81.3 m95 -121.33 109.28 14.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.644 179.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.674 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.32 168.33 19.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.028 0.442 . . . . 0.0 111.623 -178.712 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.56 -153.34 3.28 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.76 -0.733 . . . . 0.0 111.714 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.506 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.1 tp -77.13 -43.15 35.11 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.808 0.337 . . . . 0.0 111.063 179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -59.19 -48.9 79.9 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.837 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.823 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.67 -41.0 63.27 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.933 0.397 . . . . 0.0 110.851 -179.376 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.58 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -61.22 -29.56 69.9 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.263 0.554 . . . . 0.0 109.515 179.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.3 -33.5 23.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.091 -0.958 . . . . 0.0 110.502 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.823 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -64.71 -42.73 95.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.636 -179.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.621 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.5 mt -77.35 -43.12 34.01 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.71 57.71 2.58 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.73 178.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.5 -36.94 0.18 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.179 -0.919 . . . . 0.0 111.929 -179.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.531 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 6.9 m-85 -54.62 118.98 4.64 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.766 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -46.09 -51.95 12.95 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.106 0.479 . . . . 0.0 110.605 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.976 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -50.95 -53.35 33.73 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.564 179.917 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.761 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.74 -37.17 78.24 Favored 'General case' 0 CA--C 1.515 -0.368 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -61.25 -34.95 76.0 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 178.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -72.65 -46.17 55.33 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.895 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.909 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.74 -45.71 63.77 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.099 0.475 . . . . 0.0 110.004 179.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.58 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.7 OUTLIER -76.39 -29.69 57.22 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 178.92 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.567 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.22 -52.45 47.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.171 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -69.35 -30.63 68.69 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.252 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.441 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -56.16 -44.67 88.74 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.657 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.518 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 3.5 t-80 -78.19 -34.23 49.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.748 0.309 . . . . 0.0 110.351 179.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 20.3 tp60 -61.82 -52.77 62.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.482 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -63.64 -50.43 69.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.105 0.479 . . . . 0.0 110.694 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.635 HD23 HD11 ' A' ' 150' ' ' ILE . 96.4 mt -57.21 -34.65 68.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.791 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 0.3 OUTLIER -73.5 -17.48 61.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 0.0 110.697 179.511 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.34 -10.41 35.45 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.718 -179.647 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.635 HD11 HD23 ' A' ' 147' ' ' LEU . 0.9 OUTLIER -84.09 -130.23 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 110.325 -0.25 . . . . 0.0 110.325 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.95 -52.34 2.78 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.855 0.359 . . . . 0.0 110.936 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.442 ' HB1' ' NE ' ' A' ' 18' ' ' ARG . . . -54.83 138.09 43.5 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.042 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.642 ' H ' HD22 ' A' ' 153' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.164 0 CA-C-N 116.631 -0.258 . . . . 0.0 110.952 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.645 ' C2 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.411 ' HA2' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.549 0 N-CA-C 110.25 -1.14 . . . . 10.92 110.25 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.522 ' HG2' HD22 ' A' ' 3' ' ' LEU . 83.0 Cg_endo -72.41 -177.95 3.03 Favored 'Trans proline' 0 N--CA 1.447 -1.262 0 C-N-CA 124.313 3.342 . . . . 8.89 109.595 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.522 HD22 ' HG2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER 77.8 -48.63 0.49 Allowed 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.99 -0.55 . . . . 7.91 111.731 179.843 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.87 16.22 77.56 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.856 -0.688 . . . . 4.52 112.247 -179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 62.0 m -119.73 18.16 12.67 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 111.534 0.198 . . . . 3.53 111.534 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.44 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -52.73 111.66 0.7 Allowed 'General case' 0 C--N 1.345 0.371 0 N-CA-C 109.254 -0.647 . . . . 3.41 109.254 179.32 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.745 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 73.3 136.23 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.574 -0.739 . . . . 0.94 109.907 -177.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.059 HD13 ' HG2' ' A' ' 94' ' ' LYS . 1.0 OUTLIER -72.26 125.73 28.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 114.655 -1.157 . . . . 0.96 111.618 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.476 ' HB3' HG13 ' A' ' 50' ' ' VAL . 4.9 ttt180 -78.47 111.53 14.59 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.155 -0.475 . . . . 2.62 110.057 179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -129.02 168.38 16.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.776 -0.647 . . . . 0.72 110.796 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.457 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 3.1 m -157.11 122.41 4.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.21 -0.45 . . . . 0.68 110.905 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.99 171.98 14.09 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.557 -0.747 . . . . 0.45 111.421 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.476 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -126.61 117.11 22.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.987 0.394 . . . . 0.36 111.103 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.903 HD11 ' HB1' ' A' ' 139' ' ' ALA . 84.3 mt -82.79 91.2 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 N-CA-C 108.091 -1.077 . . . . 0.56 108.091 177.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.868 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -78.44 145.39 9.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 114.913 -1.04 . . . . 0.3 111.087 -178.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.702 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 41.5 p90 -149.12 121.38 8.38 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 123.431 0.457 . . . . 1.26 111.49 -179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.94 111.64 17.59 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.791 -0.448 . . . . 4.32 109.791 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -98.46 134.25 41.7 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.107 -0.497 . . . . 2.64 111.247 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.85 160.13 14.53 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.031 -0.531 . . . . 1.4 110.616 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -63.49 1.28 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.403 -0.362 . . . . 2.69 110.876 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.499 HD12 ' CE ' ' A' ' 23' ' ' LYS . 1.9 pp -133.19 150.18 74.66 Favored Pre-proline 0 C--O 1.232 0.169 0 CA-C-N 116.286 -0.416 . . . . 2.11 111.364 -179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 20.0 Cg_exo -66.32 151.36 83.52 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 122.916 2.41 . . . . 2.15 112.41 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.499 ' CE ' HD12 ' A' ' 21' ' ' ILE . 0.0 OUTLIER -105.47 -70.19 0.79 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.139 -0.482 . . . . 3.8 110.559 179.795 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.9 t -111.41 11.34 8.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-N 116.006 -0.543 . . . . 3.4 111.322 179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 61.66 38.17 15.45 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.9 0.381 . . . . 5.3 111.122 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -100.2 -69.58 0.76 Allowed 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.176 -0.465 . . . . 4.13 111.103 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -139.53 104.5 4.95 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.008 -0.542 . . . . 2.88 111.051 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -86.77 -30.96 21.18 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.996 -0.547 . . . . 0.73 110.971 179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.702 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.8 mt -121.4 135.31 61.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 CA-C-N 116.052 -0.522 . . . . 0.51 111.389 -179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.3 120.93 28.07 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.087 -0.506 . . . . 1.91 110.248 179.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.598 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 47.1 m-85 -82.1 149.62 27.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.2 -0.455 . . . . 1.27 112.209 -178.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.633 ' HB3' ' HB ' ' A' ' 15' ' ' ILE . 52.4 tp -87.18 134.07 33.57 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.743 -0.662 . . . . 0.27 110.032 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.557 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 8.2 mt -133.69 134.64 43.33 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.34 -0.391 . . . . 0.34 111.085 -179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.627 HD11 ' HG3' ' A' ' 46' ' ' PRO . 20.7 mt -113.0 113.43 25.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.074 -0.512 . . . . 0.45 110.803 -179.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -69.62 144.35 53.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.892 -0.594 . . . . 1.69 111.606 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -74.37 139.01 43.78 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.972 -0.558 . . . . 1.16 110.362 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.458 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 91.9 p -74.27 -20.58 60.1 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.034 0.383 . . . . 1.47 112.034 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.51 177.74 8.25 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.764 0.316 . . . . 2.83 111.452 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 82.95 -120.54 5.18 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.078 -0.582 . . . . 1.23 112.664 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.431 ' O ' ' CG1' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -98.01 -6.61 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-O 120.542 0.211 . . . . 1.44 110.892 179.59 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 67.97 39.81 2.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.064 0.459 . . . . 1.35 110.754 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 39.9 p-80 -72.0 144.52 48.8 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.914 -0.585 . . . . 1.2 110.834 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.557 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 56.8 m95 -95.03 122.59 37.85 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.079 -0.509 . . . . 0.65 110.852 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -145.17 144.68 24.25 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 116.003 -0.544 . . . . 0.66 110.9 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -60.48 171.61 3.26 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.775 2.316 . . . . 0.75 112.221 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.627 ' HG3' HD11 ' A' ' 34' ' ' LEU . 19.8 Cg_exo -65.04 101.86 0.41 Allowed 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.626 2.217 . . . . 0.61 112.264 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -99.14 142.87 30.07 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.207 -0.452 . . . . 1.85 110.97 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -128.55 176.71 18.13 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 121.104 -0.57 . . . . 0.77 112.56 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -110.1 103.89 12.68 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.726 0.298 . . . . 2.71 110.63 179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.602 ' N ' HG21 ' A' ' 59' ' ' THR . 1.3 p -79.31 121.43 32.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.124 0 CA-C-O 121.113 0.483 . . . . 0.93 111.106 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.41 158.38 54.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.5 -0.773 . . . . 1.98 109.978 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -47.73 -53.59 6.34 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.927 2.418 . . . . 1.4 112.453 -179.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -75.84 -13.24 83.28 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 121.014 -0.612 . . . . 1.18 113.189 179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -81.87 155.33 25.39 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.884 0.342 . . . . 1.43 111.114 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 34.9 t70 -79.27 158.3 27.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.244 -0.434 . . . . 1.33 110.702 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.465 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.9 OUTLIER -69.3 -62.32 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.852 -0.613 . . . . 1.74 111.598 -179.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.736 HD21 HG21 ' A' ' 77' ' ' ILE . 9.1 tp -62.51 -40.23 96.06 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.789 -0.187 . . . . 0.61 111.485 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.84 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -51.6 -40.76 60.43 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 122.972 0.17 . . . . 1.91 110.692 179.657 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.602 HG21 ' N ' ' A' ' 50' ' ' VAL . 96.3 m -61.9 -46.96 87.09 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 110.057 -0.349 . . . . 0.63 110.057 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.24 -43.23 99.31 Favored 'General case' 0 N--CA 1.462 0.141 0 N-CA-C 109.63 -0.507 . . . . 0.48 109.63 178.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.85 HD22 ' HB2' ' A' ' 72' ' ' ALA . 97.9 mt -60.39 -52.77 63.81 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.371 -0.831 . . . . 0.5 110.901 179.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.06 -42.62 85.86 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.868 -0.606 . . . . 2.79 110.809 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.44 -35.64 79.89 Favored 'General case' 0 N--CA 1.461 0.11 0 CA-C-N 116.29 -0.413 . . . . 0.44 111.098 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.868 HG23 HD11 ' A' ' 15' ' ' ILE . 63.5 m -63.99 -43.28 96.17 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 116.192 -0.458 . . . . 0.34 111.208 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.584 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 3.9 pt20 -80.08 -24.64 40.48 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 111.536 0.199 . . . . 1.71 111.536 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -79.93 -46.05 17.43 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.695 -0.23 . . . . 1.77 111.465 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 21.9 mt-10 -97.81 -11.45 23.3 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 112.679 0.622 . . . . 2.0 112.679 -179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.677 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -131.96 -3.46 3.6 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.83 0.678 . . . . 0.37 112.83 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.432 ' HA3' ' HD2' ' A' ' 111' ' ' ARG . . . 69.65 6.34 54.77 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 120.391 -0.909 . . . . 0.37 113.546 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.606 ' O ' HG22 ' A' ' 64' ' ' THR . 2.4 mt -111.09 120.12 61.07 Favored 'Isoleucine or valine' 0 C--N 1.341 0.23 0 CA-C-N 117.378 0.589 . . . . 0.34 111.346 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.6 pt-20 -97.0 172.27 7.96 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.247 -0.433 . . . . 1.82 110.642 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -50.68 -42.01 56.36 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 111.998 0.37 . . . . 0.45 111.998 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.78 -25.7 71.87 Favored Glycine 0 CA--C 1.523 0.585 0 C-N-CA 120.998 -0.62 . . . . 0.48 112.742 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.534 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 5.9 tp60 -86.87 2.86 47.72 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 111.773 0.286 . . . . 1.54 111.773 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.841 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -139.48 -164.34 1.66 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 120.663 0.268 . . . . 0.44 110.5 178.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.436 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 31.4 m -143.02 100.85 3.72 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.331 -0.395 . . . . 0.51 110.168 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.736 HG21 HD21 ' A' ' 57' ' ' LEU . 9.2 mm -75.11 118.06 20.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-N 115.99 -0.55 . . . . 0.55 111.414 -179.238 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.596 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.1 mp -78.7 136.93 22.87 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 115.712 -0.677 . . . . 0.57 110.682 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -92.99 146.96 23.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.423 -0.808 . . . . 1.5 111.129 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.98 -28.36 15.61 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.822 -0.704 . . . . 0.75 113.063 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD21 ' A' ' 100' ' ' LEU . 37.9 t80 -98.88 128.91 45.19 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.984 0.421 . . . . 1.34 111.633 -179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -158.25 126.87 5.48 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 115.707 -0.679 . . . . 1.41 110.655 178.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -152.01 129.57 11.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.91 -0.586 . . . . 3.01 110.75 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.739 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -110.74 137.49 48.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.886 0.374 . . . . 1.42 111.248 179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.973 HD13 ' HB2' ' A' ' 135' ' ' GLU . 8.8 mt -102.2 121.61 42.57 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.781 -0.645 . . . . 0.69 110.553 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.478 HD21 HG23 ' A' ' 95' ' ' THR . 4.7 m-80 -110.27 127.26 54.91 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.301 -0.409 . . . . 1.75 111.773 -178.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.641 ' HB2' ' N1 ' ' A' ' 154' ' ' ATP . 14.5 p90 -167.3 141.6 3.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.788 -0.642 . . . . 1.48 111.428 179.493 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.55 ' O ' HG13 ' A' ' 88' ' ' VAL . 9.9 p -82.77 112.6 20.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 109.49 -0.559 . . . . 0.91 109.49 177.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.499 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -72.76 -91.56 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.34 -0.391 . . . . 0.9 111.38 -178.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.1 ptt180 -82.69 -44.76 15.3 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-O 120.877 0.37 . . . . 3.5 110.09 179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -169.95 31.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.869 -0.605 . . . . 2.28 111.0 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.989 ' HB3' HD11 ' A' ' 8' ' ' LEU . 8.7 tptt -161.16 126.19 2.17 Favored Pre-proline 0 CA--C 1.532 0.254 0 CA-C-O 120.981 0.42 . . . . 2.21 110.904 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.876 ' O ' HD12 ' A' ' 8' ' ' LEU . 55.6 Cg_endo -66.41 121.34 8.59 Favored 'Trans proline' 0 N--CA 1.476 0.457 0 C-N-CA 123.745 2.963 . . . . 0.91 112.715 179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 1.059 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -101.69 121.33 41.84 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.002 -0.545 . . . . 1.58 111.713 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.478 HG23 HD21 ' A' ' 86' ' ' ASN . 90.1 m -92.76 106.25 18.25 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.93 -0.767 . . . . 0.83 108.93 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.58 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.0 t -107.01 106.46 20.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 N-CA-C 111.735 0.272 . . . . 0.67 111.735 -178.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.739 HD13 ' HB3' ' A' ' 84' ' ' GLU . 0.8 OUTLIER -87.0 124.63 40.65 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 N-CA-C 109.259 -0.645 . . . . 0.75 109.259 178.517 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.512 ' HB3' HG13 ' A' ' 14' ' ' ILE . 45.5 m-85 -109.01 158.04 18.1 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.876 0.695 . . . . 1.28 112.876 -177.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.474 ' CD2' HD13 ' A' ' 57' ' ' LEU . 15.2 m-90 -141.39 157.98 44.47 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 114.762 -1.108 . . . . 0.72 109.82 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.596 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 2.0 mt -92.63 108.29 19.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.679 0.276 . . . . 0.54 110.261 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.535 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -117.97 125.29 50.11 Favored 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.432 -0.349 . . . . 0.35 110.645 -179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.528 ' HB2' ' CZ ' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -104.93 113.89 27.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.226 -0.443 . . . . 1.38 111.093 -179.377 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.841 HG12 HD23 ' A' ' 75' ' ' LEU . 10.2 m -72.61 125.63 31.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.158 0 CA-C-O 121.127 0.489 . . . . 0.53 110.404 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.503 ' HE2' ' HB3' ' A' ' 104' ' ' LYS . 0.0 OUTLIER -70.37 -16.49 62.98 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.667 -0.697 . . . . 1.44 112.646 -178.338 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.753 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 1.1 t70 -105.05 129.85 53.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 120.757 0.313 . . . . 2.39 111.042 179.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.4 -41.04 73.52 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 2.98 109.932 179.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.83 32.07 3.85 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.785 -0.643 . . . . 2.29 110.325 178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.753 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 2.6 p -52.14 140.61 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.249 0 CA-C-N 115.93 -0.577 . . . . 0.59 110.33 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 109' ' ' GLU . 0.3 OUTLIER -62.0 140.65 58.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.259 0.552 . . . . 1.26 111.693 -178.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.782 HG21 ' CG ' ' A' ' 119' ' ' TYR . 41.4 mm -120.39 98.84 6.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.245 -0.889 . . . . 0.46 110.012 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.432 ' HD2' ' HA3' ' A' ' 69' ' ' GLY . 5.4 mtt180 -101.01 98.48 8.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.532 -0.758 . . . . 3.2 110.844 -178.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.705 HD21 ' CG2' ' A' ' 110' ' ' ILE . 6.4 mt -87.67 146.0 25.9 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.589 -0.732 . . . . 0.75 111.73 -179.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.2 m -91.07 -172.35 3.29 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.709 -0.678 . . . . 1.55 110.718 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 3.7 m170 -60.28 -28.77 68.35 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.718 -0.219 . . . . 2.76 111.531 179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.75 -44.52 73.58 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 111.798 0.295 . . . . 2.63 111.798 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -104.34 123.75 47.96 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.814 0.34 . . . . 1.32 111.498 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 4.0 pt20 -95.42 -26.34 15.9 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.076 -0.511 . . . . 2.68 111.814 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -141.61 168.12 20.52 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.03 0.443 . . . . 0.64 111.654 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.782 ' CG ' HG21 ' A' ' 110' ' ' ILE . 31.5 p90 -148.24 161.78 40.81 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 115.71 -0.677 . . . . 1.33 110.635 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 32.5 mtt180 -153.78 153.97 33.15 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.139 0.495 . . . . 2.05 111.655 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.561 ' CE2' HD13 ' A' ' 32' ' ' LEU . 82.9 m95 -117.28 106.94 13.81 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.256 -0.884 . . . . 0.46 109.049 178.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -135.42 168.77 18.59 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.938 0.399 . . . . 0.45 111.829 -178.117 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.48 -158.13 6.95 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.835 -0.621 . . . . 0.43 112.209 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.4 tp -72.71 -45.79 56.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.596 0.198 . . . . 0.5 111.17 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 13.6 pt-20 -58.36 -48.65 79.9 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.128 0.418 . . . . 1.34 112.128 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.774 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -74.03 -42.09 60.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.689 -0.232 . . . . 1.28 111.041 -179.465 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.557 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -59.99 -31.01 69.51 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.844 -0.428 . . . . 0.37 109.844 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.65 -37.56 35.7 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.62 -0.718 . . . . 1.46 110.263 178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.774 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -59.47 -42.67 92.57 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.402 -0.363 . . . . 1.29 111.042 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.598 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.7 OUTLIER -78.22 -42.51 31.08 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.348 -0.387 . . . . 0.51 110.849 179.174 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.793 ' HB1' ' HB3' ' A' ' 136' ' ' MET . . . -79.04 56.41 1.98 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.202 0.525 . . . . 0.5 109.858 178.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.31 -39.48 0.28 Allowed 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 114.824 -1.08 . . . . 2.53 111.951 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.519 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 56.5 m-85 -56.08 120.39 7.41 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.18 -0.464 . . . . 1.51 109.877 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -45.59 -57.21 4.35 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 112.931 0.715 . . . . 1.86 112.931 -177.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.973 ' HB2' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -47.58 -47.2 28.61 Favored 'General case' 0 N--CA 1.472 0.654 0 O-C-N 123.177 0.298 . . . . 1.71 111.391 -179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.793 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.07 -46.75 87.48 Favored 'General case' 0 N--CA 1.456 -0.149 0 N-CA-C 110.196 -0.298 . . . . 0.62 110.196 179.835 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.61 -40.92 72.74 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.893 -0.594 . . . . 1.41 110.078 178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.523 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -69.8 -41.88 74.47 Favored 'General case' 0 CA--C 1.527 0.068 0 CA-C-N 115.97 -0.559 . . . . 0.57 111.143 179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.903 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.51 -46.89 80.29 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.95 0.405 . . . . 0.49 109.967 179.003 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.5 mt -71.76 -31.16 66.36 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.625 -0.716 . . . . 0.41 110.042 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -65.89 -51.75 56.03 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.918 -0.583 . . . . 1.19 111.187 179.579 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -68.56 -31.7 71.11 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.097 -0.501 . . . . 2.28 110.928 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -60.2 -46.09 94.87 Favored Glycine 0 C--N 1.338 0.662 0 C-N-CA 120.786 -0.721 . . . . 0.49 111.655 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -72.12 -36.09 69.31 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.551 0.215 . . . . 1.38 110.537 178.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.9 tp60 -64.7 -52.71 55.72 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.276 -0.42 . . . . 1.47 111.441 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -56.66 -51.38 68.98 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.084 -0.507 . . . . 1.36 111.065 -179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.671 HD23 HD11 ' A' ' 150' ' ' ILE . 87.5 mt -59.13 -37.26 76.82 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.112 -0.494 . . . . 0.64 111.671 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 2.0 t -70.45 -19.33 62.97 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 120.615 0.245 . . . . 1.04 110.72 178.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -12.14 48.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.372 -0.376 . . . . 1.01 111.503 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.671 HD11 HD23 ' A' ' 147' ' ' LEU . 1.7 mt -79.68 -128.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 110.093 -0.336 . . . . 1.12 110.093 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -136.2 -61.51 0.7 Allowed 'General case' 0 C--O 1.232 0.173 0 CA-C-N 117.934 0.334 . . . . 3.45 111.009 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -156.6 -49.88 0.07 Allowed 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.216 -0.447 . . . . 3.59 111.251 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 2.6 mt . . . . . 0 N--CA 1.464 0.258 0 CA-C-N 116.265 -0.425 . . . . 7.0 111.218 179.995 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.641 ' N1 ' ' HB2' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -72.37 149.82 51.33 Favored 'Trans proline' 0 N--CA 1.447 -1.261 0 C-N-CA 124.283 3.322 . . . . 0.0 109.625 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.08 97.48 0.09 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.902 0.382 . . . . 0.0 110.757 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -144.09 -146.47 4.52 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.246 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.0 t -88.07 2.14 52.62 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.9 ttp 60.82 158.32 0.04 OUTLIER 'General case' 0 C--O 1.232 0.161 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 -179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.8 174.52 0.15 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.984 0.421 . . . . 0.0 110.707 -179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.906 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.47 126.17 54.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.517 179.549 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.812 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.8 OUTLIER -78.19 123.82 27.36 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.859 -179.808 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 48' ' ' GLY . . . -142.83 160.03 41.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.122 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.476 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 80.0 m -150.72 123.79 8.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.176 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.578 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -111.74 177.25 18.74 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 178.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.446 ' HA ' HD23 ' A' ' 13' ' ' LEU . 0.4 OUTLIER -130.26 118.18 20.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 117.589 0.695 . . . . 0.0 112.328 -179.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.724 HD11 ' HB1' ' A' ' 139' ' ' ALA . 78.8 mt -82.64 91.47 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 177.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 27.5 mt -81.51 145.9 8.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.339 -178.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.649 ' HA ' ' O ' ' A' ' 30' ' ' GLU . 35.5 p90 -152.94 127.27 9.22 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.372 -178.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.503 ' HG3' ' HA ' ' A' ' 106' ' ' TYR . 0.0 OUTLIER -88.08 113.02 23.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.006 0.431 . . . . 0.0 110.119 178.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.12 125.06 34.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.954 -0.567 . . . . 0.0 111.466 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -83.85 154.87 23.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.379 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 18.7 mt -59.48 -81.19 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.771 -179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.555 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.8 pp -109.07 150.37 40.88 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.638 179.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_exo -65.48 152.45 81.85 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.677 2.252 . . . . 0.0 112.408 -179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.41 ' HE3' ' O ' ' A' ' 21' ' ' ILE . 0.1 OUTLIER -122.7 -78.8 0.6 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.778 179.735 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.424 ' O ' HG12 ' A' ' 24' ' ' VAL . 20.4 t -86.95 -9.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.699 -179.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 64.76 22.67 12.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.85 0.357 . . . . 0.0 110.811 -179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -73.99 -78.9 0.09 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.498 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.526 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 0.9 OUTLIER -123.17 -31.75 3.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.851 179.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.526 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 73.86 -54.61 0.68 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.533 179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.581 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 3.8 mt -102.39 149.72 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.705 -179.066 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.649 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.8 mp0 -116.7 172.65 7.09 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.036 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.549 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 27.9 m-85 -135.14 129.11 33.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.564 0.221 . . . . 0.0 111.14 -179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 15' ' ' ILE . 55.9 tp -71.95 133.08 45.15 Favored 'General case' 0 CA--C 1.522 -0.097 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.593 HD22 ' HB3' ' A' ' 43' ' ' TRP . 4.0 mt -133.99 144.74 48.92 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.729 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 112' ' ' LEU . 51.7 mt -123.41 109.73 14.23 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.065 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.488 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 5.1 tt0 -72.62 143.38 48.2 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.423 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.82 176.53 0.39 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.636 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.543 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 21.7 p -103.36 -9.73 19.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.562 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -164.0 -172.96 2.99 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.777 0.322 . . . . 0.0 110.69 179.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 76.38 -123.96 7.02 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.351 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.545 ' O ' HG12 ' A' ' 40' ' ' ILE . 8.9 tt -90.46 -3.65 10.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.767 0.318 . . . . 0.0 111.045 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 62.97 29.77 16.44 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.78 0.324 . . . . 0.0 110.674 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 36.4 p-80 -57.3 151.74 15.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.576 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.682 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.8 m95 -103.91 140.93 37.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.305 -179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.691 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -163.43 141.8 6.22 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.901 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.455 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 38.5 Cg_endo -66.42 169.11 14.68 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.367 2.044 . . . . 0.0 111.896 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.607 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 51.7 Cg_exo -51.69 103.98 0.08 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.594 2.196 . . . . 0.0 112.644 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -97.61 124.05 41.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.967 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.502 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.26 169.68 13.39 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.322 179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -118.25 104.84 11.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.942 0.401 . . . . 0.0 110.702 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.812 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.56 129.29 37.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.425 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.655 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.7 OUTLIER -91.48 177.36 2.25 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.408 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.655 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.5 Cg_exo -57.34 -54.2 3.81 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.402 2.068 . . . . 0.0 112.87 -179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.23 3.73 86.56 Favored Glycine 0 CA--C 1.519 0.329 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.373 -179.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.572 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 21.6 tt0 -84.43 171.24 12.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.901 0.35 . . . . 0.0 110.736 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.884 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 9.7 t70 -97.06 157.73 15.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.273 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.543 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 12.9 m-20 -70.04 -64.92 0.79 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.281 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.59 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 22.7 tp -62.79 -42.93 99.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.113 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.884 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -49.35 -43.08 43.61 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.681 -0.236 . . . . 0.0 110.543 -179.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.476 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 25.9 m -58.56 -45.26 89.36 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.578 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -69.04 -30.04 68.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.823 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.756 HD22 ' HB2' ' A' ' 72' ' ' ALA . 88.4 mt -72.93 -51.85 16.91 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.118 179.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -41.71 95.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.802 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.502 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -61.39 -39.57 91.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.173 0.511 . . . . 0.0 109.826 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 87.5 m -58.18 -47.03 84.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.891 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.476 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 13.2 pt20 -80.0 -25.15 40.39 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.978 0.418 . . . . 0.0 110.484 179.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.82 -30.06 50.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.718 179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.509 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 69.2 mm-40 -107.68 -27.07 10.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.772 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -121.8 -7.93 8.98 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.895 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 79.49 -8.87 45.33 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 119.712 -1.232 . . . . 0.0 112.77 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.675 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.6 mt -93.82 132.71 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 CA-C-O 120.866 0.365 . . . . 0.0 110.468 -179.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.517 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pt-20 -116.52 170.18 8.76 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.21 -179.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.85 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.5 -39.53 10.95 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.984 179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.47 -21.66 68.89 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.435 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.444 ' HB3' ' CG2' ' A' ' 70' ' ' ILE . 7.1 tp60 -100.66 -3.39 30.42 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.85 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -133.03 -170.9 2.55 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.273 -0.269 . . . . 0.0 110.273 178.211 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.573 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 57.4 m -136.36 98.18 3.77 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.751 0.31 . . . . 0.0 111.617 -179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.575 HG21 ' CD2' ' A' ' 57' ' ' LEU . 5.7 mm -69.28 127.89 31.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.137 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.472 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -92.43 137.76 21.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.658 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -97.98 151.3 20.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.126 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.11 -31.22 8.9 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.975 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.789 ' CE1' HD21 ' A' ' 100' ' ' LEU . 10.3 t80 -103.64 105.17 15.32 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 120.894 0.378 . . . . 0.0 110.72 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.473 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.7 OUTLIER -135.68 122.35 20.94 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.339 0.59 . . . . 0.0 110.639 179.589 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -140.9 148.33 40.28 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.917 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.866 ' HB3' HD13 ' A' ' 97' ' ' ILE . 3.8 pm0 -133.06 125.36 29.45 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.431 179.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.902 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.2 mt -91.95 116.68 29.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.046 179.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.475 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 3.0 p30 -116.81 129.92 56.39 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.829 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.567 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 19.4 p90 -166.75 141.76 4.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.209 -179.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.65 HG23 ' N ' ' A' ' 92' ' ' LYS . 7.7 p -81.99 111.42 18.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.847 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.792 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -76.48 -83.59 0.07 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.887 -178.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.12 -37.47 18.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.066 0.46 . . . . 0.0 110.932 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.9 t30 177.64 26.44 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.534 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.785 ' HB3' HD11 ' A' ' 8' ' ' LEU . 2.7 tptt -155.11 120.85 2.62 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.947 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.848 ' O ' HD12 ' A' ' 8' ' ' LEU . 43.4 Cg_endo -68.73 117.84 5.27 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.372 2.715 . . . . 0.0 113.053 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.906 ' HG2' HD13 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -100.58 115.46 30.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.985 -179.356 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 48.0 m -86.28 120.75 27.97 Favored 'General case' 0 CA--C 1.521 -0.16 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 177.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.715 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 43.2 t -116.67 108.12 24.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.014 -0.275 . . . . 0.0 111.692 -178.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.866 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -84.52 125.63 40.27 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.394 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.535 ' HB3' ' CD1' ' A' ' 14' ' ' ILE . 9.4 m-85 -113.15 130.75 56.1 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.144 -177.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.547 ' CD2' HD13 ' A' ' 57' ' ' LEU . 3.7 m-90 -114.9 156.86 24.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.698 178.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.789 HD21 ' CE1' ' A' ' 81' ' ' PHE . 2.1 mt -93.18 113.13 25.28 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.573 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -124.81 148.94 47.9 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 120.966 0.412 . . . . 0.0 111.788 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.603 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 0.2 OUTLIER -123.38 117.94 26.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.129 -179.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.706 HG12 HD23 ' A' ' 75' ' ' LEU . 7.6 m -71.94 132.61 33.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.853 0.358 . . . . 0.0 110.367 179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -64.85 -20.68 66.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.702 -178.283 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.724 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 60.3 t0 -111.89 120.57 42.38 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.667 0.617 . . . . 0.0 112.667 -178.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.503 ' HA ' ' HG3' ' A' ' 17' ' ' ARG . 8.1 t80 -58.98 -38.12 78.4 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.353 178.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -105.69 26.1 9.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.996 179.039 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.724 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 5.6 p -43.3 149.02 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.456 -179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.583 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.1 OUTLIER -70.21 142.93 52.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.222 0.535 . . . . 0.0 111.298 -179.099 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.832 HG21 ' CG ' ' A' ' 119' ' ' TYR . 46.1 mm -120.15 99.67 7.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.758 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.895 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 3.9 mtp180 -98.77 100.4 11.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.913 -179.352 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.563 HD22 HD22 ' A' ' 34' ' ' LEU . 14.0 mt -90.3 153.7 20.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.834 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -113.77 -166.84 1.13 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.501 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 16.0 m80 -68.21 -1.45 6.16 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -91.37 -27.65 18.21 Favored 'General case' 0 C--N 1.335 -0.051 0 CA-C-O 120.838 0.351 . . . . 0.0 110.722 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.543 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 23.5 m80 -127.15 141.38 51.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.689 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.543 ' HB2' ' HA ' ' A' ' 37' ' ' SER . 5.0 tp-100 -100.58 -17.64 16.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 112.082 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -166.44 169.44 13.91 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.971 0.415 . . . . 0.0 111.515 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.832 ' CG ' HG21 ' A' ' 110' ' ' ILE . 35.9 p90 -140.42 174.96 10.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.112 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.56 163.07 33.03 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.313 0.578 . . . . 0.0 111.682 179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.485 ' C ' ' HG ' ' A' ' 122' ' ' LEU . 72.4 m95 -128.83 107.67 9.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.047 179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.589 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -142.43 166.68 24.03 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.18 0.514 . . . . 0.0 111.819 -178.185 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.32 -151.34 1.72 Allowed Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.313 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.543 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.1 tp -76.98 -47.19 21.47 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.923 0.392 . . . . 0.0 111.19 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -56.88 -51.79 67.71 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.787 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.822 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.2 OUTLIER -68.96 -48.93 61.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.949 0.404 . . . . 0.0 110.787 -179.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.484 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -54.66 -29.24 52.01 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.323 0.582 . . . . 0.0 109.926 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 5.1 m -84.46 -32.58 23.96 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.407 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.822 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.64 -43.56 84.31 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.808 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.682 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.1 mt -77.42 -42.91 34.38 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.45 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -79.2 51.86 1.24 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 178.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.466 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.93 -29.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.707 -179.194 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.504 ' CE2' ' C8 ' ' A' ' 154' ' ' ATP . 13.7 m-85 -60.47 119.84 8.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.327 179.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -46.48 -48.37 19.1 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.876 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.902 ' HB3' HD13 ' A' ' 85' ' ' LEU . 34.0 mp0 -48.16 -54.58 12.89 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.666 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.691 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -65.13 -42.17 94.13 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.33 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.61 -39.32 61.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.841 0.353 . . . . 0.0 110.059 179.521 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.552 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.28 -46.75 60.15 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.771 179.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.724 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.4 -49.76 60.95 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.665 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.509 HD12 ' O ' ' A' ' 136' ' ' MET . 0.3 OUTLIER -72.94 -32.02 64.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.953 178.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.552 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.2 OUTLIER -59.66 -52.29 66.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.248 179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.432 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 3.0 mt-10 -71.55 -27.48 63.21 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.949 -179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -56.98 -42.73 92.97 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.894 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.468 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -76.27 -36.58 58.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.016 0.436 . . . . 0.0 110.22 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -63.48 -52.6 60.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.05 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -65.33 -51.95 57.21 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.463 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.717 HD23 HD11 ' A' ' 150' ' ' ILE . 75.5 mt -56.96 -25.16 57.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.886 -179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.4 t -78.39 -18.64 54.77 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.747 0.308 . . . . 0.0 110.611 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.16 -12.21 36.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.697 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.717 HD11 HD23 ' A' ' 147' ' ' LEU . 0.8 OUTLIER -84.78 -130.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 120.645 -0.422 . . . . 0.0 110.101 179.57 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.423 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 3.6 tt0 -170.22 -58.64 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.965 0.412 . . . . 0.0 110.555 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -159.68 -50.17 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.946 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.969 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.792 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.857 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.504 0 N-CA-C 110.267 -1.133 . . . . 0.0 110.267 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.857 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 82.6 Cg_endo -72.39 171.88 16.11 Favored 'Trans proline' 0 N--CA 1.446 -1.285 0 C-N-CA 124.315 3.344 . . . . 0.0 109.62 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 tt -59.81 128.66 38.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.902 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -127.17 83.82 0.34 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.754 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 67.3 p -169.41 -23.33 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.523 0.202 . . . . 0.0 111.42 179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -72.86 125.36 27.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.795 0.331 . . . . 0.0 110.531 179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 62.91 174.3 0.15 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.109 0.481 . . . . 0.0 110.925 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.982 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.24 139.42 44.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.208 179.2 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.862 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtt180 -82.8 125.02 30.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.366 -179.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.733 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -137.64 165.93 25.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.991 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.6 m -160.59 123.82 3.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.298 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.577 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -116.02 172.3 14.16 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.72 178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.682 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.5 OUTLIER -125.46 117.92 24.7 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.169 0.484 . . . . 0.0 112.03 -179.432 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 1.002 HD11 ' HB1' ' A' ' 139' ' ' ALA . 43.2 mt -83.74 92.02 2.82 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 18.2 mt -82.45 146.15 7.55 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.982 -178.211 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.741 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 53.7 p90 -152.24 121.41 6.7 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.278 -179.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 2.5 ptm180 -82.16 114.69 20.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.224 0.535 . . . . 0.0 110.25 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.421 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 23.8 ttp85 -98.08 124.07 42.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.248 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 160.16 28.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.606 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 12.6 mt -50.38 -54.22 23.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.123 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.441 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.7 pp -146.2 150.15 40.58 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.222 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 16.6 Cg_exo -67.08 157.79 60.0 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.657 2.238 . . . . 0.0 112.184 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.65 -80.0 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.772 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.409 ' O ' HG12 ' A' ' 24' ' ' VAL . 22.6 t -91.2 -10.81 9.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.064 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 t0 71.48 7.96 6.14 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.184 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.1 t-20 -81.46 -80.01 0.16 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 120.806 0.336 . . . . 0.0 110.189 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -108.56 97.06 6.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.071 178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.6 -46.6 3.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.404 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.741 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 6.2 mt -107.64 143.87 17.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 111.905 -179.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.626 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.8 OUTLIER -132.79 126.84 33.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.104 179.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 63.3 m-85 -89.71 151.68 21.73 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.609 HD23 ' CD1' ' A' ' 15' ' ' ILE . 47.8 tp -86.72 133.99 33.63 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.0 178.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.577 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 6.3 mt -135.23 144.33 46.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.932 0.396 . . . . 0.0 111.02 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 112' ' ' LEU . 14.4 mt -123.61 113.24 18.41 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.086 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.491 ' HB2' ' CE2' ' A' ' 43' ' ' TRP . 15.5 tt0 -74.1 140.48 45.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.209 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.98 157.06 22.78 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.505 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.501 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 3.0 p -82.81 1.93 36.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.468 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.05 -164.82 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.896 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 73.31 -121.3 7.46 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.343 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.537 HG12 ' O ' ' A' ' 40' ' ' ILE . 13.5 tt -93.44 0.55 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.819 0.342 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 58.67 32.51 22.25 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.886 0.374 . . . . 0.0 110.799 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.42 ' HB3' HG23 ' A' ' 40' ' ' ILE . 46.2 p-80 -67.02 142.12 57.32 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.764 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.694 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 46.6 m95 -98.71 140.79 32.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.67 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.793 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -163.27 142.59 6.66 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.964 -179.718 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.45 175.95 0.47 Allowed 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.383 2.055 . . . . 0.0 112.105 179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.684 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 6.8 Cg_exo -73.3 102.4 1.47 Allowed 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.851 2.367 . . . . 0.0 112.428 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.7 OUTLIER -110.36 157.59 19.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.95 0.405 . . . . 0.0 111.393 179.435 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -148.84 173.01 28.89 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.5 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 26.1 t-80 -99.29 110.53 23.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.763 0.316 . . . . 0.0 110.948 179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.862 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.5 p -76.92 134.6 28.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.005 0.431 . . . . 0.0 110.74 179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.726 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 8.6 tt0 -90.63 150.99 43.45 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.239 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 10.1 Cg_endo -53.5 -21.82 19.78 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.861 2.374 . . . . 0.0 113.033 -178.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.725 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -101.64 -9.75 42.71 Favored Glycine 0 CA--C 1.519 0.297 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.337 179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -89.64 171.49 9.64 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.607 0.241 . . . . 0.0 110.873 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.926 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 21.9 t70 -87.84 160.98 17.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.046 0.45 . . . . 0.0 110.651 179.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.588 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 16.7 m-20 -71.52 -58.99 3.0 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.146 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 77' ' ' ILE . 23.0 tp -65.97 -42.13 90.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.211 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.926 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.5 OUTLIER -49.82 -42.54 47.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.7 0.286 . . . . 0.0 110.503 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.541 ' OG1' ' HB ' ' A' ' 50' ' ' VAL . 98.5 m -60.48 -44.08 96.3 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -70.17 -30.35 67.45 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.002 -0.544 . . . . 0.0 109.879 178.387 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.847 HD22 ' HB2' ' A' ' 72' ' ' ALA . 89.8 mt -71.83 -51.98 19.77 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.354 179.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.1 ttt180 -60.61 -42.35 96.63 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.593 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 66' ' ' GLU . . . -59.52 -33.58 71.55 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 121.178 0.513 . . . . 0.0 109.779 178.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 66.5 m -59.14 -53.64 56.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.301 178.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.534 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.7 pt20 -72.6 -20.94 61.21 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.028 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 1.5 mm-40 -77.96 -40.25 39.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.841 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.684 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 59.1 mm-40 -111.34 12.8 21.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.346 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -154.54 -11.74 0.13 Allowed 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.079 0.399 . . . . 0.0 112.079 179.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.618 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 71.05 2.41 46.86 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.291 -0.957 . . . . 0.0 113.123 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.673 ' O ' HG22 ' A' ' 64' ' ' THR . 1.5 mt -105.47 129.65 58.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.815 179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.8 pm0 -110.17 172.38 6.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.648 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.27 -36.26 20.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.15 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -68.68 -18.96 72.65 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.062 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.517 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 4.7 mt-30 -100.76 -5.02 26.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.546 0.213 . . . . 0.0 111.28 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.936 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -132.75 -170.15 2.39 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.417 177.943 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.561 ' H ' ' H ' ' A' ' 102' ' ' GLU . 55.2 m -133.54 100.37 4.78 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.049 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 57' ' ' LEU . 17.7 mm -74.39 123.38 29.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.242 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.592 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -83.32 139.06 18.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.867 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -97.88 144.98 26.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.173 -179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.2 -23.52 31.72 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.884 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.583 ' CE1' HD21 ' A' ' 100' ' ' LEU . 11.0 t80 -103.44 128.55 50.57 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.155 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.483 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -157.98 130.98 7.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.265 179.485 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -151.99 137.27 17.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.913 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.95 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -120.52 134.07 55.32 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.134 0.492 . . . . 0.0 112.04 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.998 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.9 mt -96.32 121.19 37.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.271 179.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.451 HD21 HG23 ' A' ' 95' ' ' THR . 1.9 m-80 -111.68 123.71 50.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.014 0.435 . . . . 0.0 110.731 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.56 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 27.1 p90 -166.95 141.58 3.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.037 -179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.582 HG23 ' N ' ' A' ' 92' ' ' LYS . 7.5 p -83.6 112.69 21.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.689 179.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.538 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -75.7 -97.25 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.674 -178.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -74.05 -36.29 64.36 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.777 0.322 . . . . 0.0 110.943 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.44 ' N ' ' HG3' ' A' ' 90' ' ' ARG . 6.7 t-20 178.98 24.82 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.218 179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.802 ' HB3' HD11 ' A' ' 8' ' ' LEU . 4.6 tptt -155.32 126.95 3.73 Favored Pre-proline 0 CA--C 1.532 0.281 0 CA-C-O 120.812 0.339 . . . . 0.0 110.891 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.906 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.3 Cg_endo -69.5 119.89 6.79 Favored 'Trans proline' 0 CA--C 1.515 -0.438 0 C-N-CA 123.437 2.758 . . . . 0.0 112.876 -179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.982 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.9 mmmt -101.51 129.39 47.57 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.04 -179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.451 HG23 HD21 ' A' ' 86' ' ' ASN . 24.2 m -95.49 114.62 26.4 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 177.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.763 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.4 t -113.75 107.76 23.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.4 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.95 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.7 mm -86.37 120.33 35.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.694 ' HB3' HG13 ' A' ' 14' ' ' ILE . 8.5 m-85 -104.17 128.53 51.87 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.042 0.448 . . . . 0.0 111.705 -178.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.588 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 7.9 m-90 -114.4 152.8 30.95 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.437 179.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.583 HD21 ' CE1' ' A' ' 81' ' ' PHE . 1.1 mt -88.59 121.37 30.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.143 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -130.8 144.71 51.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.561 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.9 tt0 -122.83 113.85 19.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.387 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.936 HG12 HD23 ' A' ' 75' ' ' LEU . 17.4 m -72.78 115.45 13.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-O 121.399 0.619 . . . . 0.0 110.869 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.517 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 0.1 OUTLIER -60.24 -26.74 66.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.662 -178.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.914 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 2.1 m-20 -93.8 110.1 21.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.19 0.519 . . . . 0.0 111.501 -179.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -58.38 -38.49 77.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.391 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.09 26.13 9.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.807 179.107 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.914 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 5.9 p -47.85 149.45 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.353 -0.84 . . . . 0.0 111.419 -179.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -73.39 142.31 46.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.134 0.493 . . . . 0.0 110.786 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.77 HG21 ' CG ' ' A' ' 119' ' ' TYR . 37.9 mm -118.27 99.65 8.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.87 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.618 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.1 OUTLIER -103.2 97.96 7.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.127 -179.457 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 34' ' ' LEU . 5.5 mt -84.71 -177.75 6.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.775 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 67' ' ' GLU . 0.3 OUTLIER -120.44 -166.14 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.677 179.527 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.0 t-80 -68.58 -14.99 63.38 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.685 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.28 -19.61 23.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.687 0.279 . . . . 0.0 111.405 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.518 ' CE1' ' HB2' ' A' ' 34' ' ' LEU . 84.0 m-70 -119.76 122.08 40.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.899 -179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.501 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 3.3 pt20 -103.75 -7.67 20.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.601 -179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -165.7 154.78 11.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.047 0.451 . . . . 0.0 111.24 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.77 ' CG ' HG21 ' A' ' 110' ' ' ILE . 43.6 p90 -134.45 171.61 14.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.493 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 72.6 mtt180 -157.78 157.82 34.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.211 0.529 . . . . 0.0 111.506 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.581 ' C ' ' HG2' ' A' ' 30' ' ' GLU . 73.3 m95 -122.47 109.55 14.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.521 178.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.715 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.94 170.67 15.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.007 0.432 . . . . 0.0 111.458 -178.651 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -75.43 -155.13 4.95 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.075 179.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.2 tp -75.17 -41.23 58.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.652 0.263 . . . . 0.0 111.084 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 12.3 pt-20 -62.3 -51.24 68.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.629 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.715 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -70.37 -45.54 65.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.0 0.428 . . . . 0.0 110.479 -179.525 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.577 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -57.73 -29.98 65.18 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.238 0.542 . . . . 0.0 109.692 178.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 4.2 m -83.91 -32.1 25.3 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.32 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.598 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.9 OUTLIER -64.59 -44.27 91.16 Favored 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.757 -179.853 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.694 ' HB3' ' CD1' ' A' ' 43' ' ' TRP . 1.0 OUTLIER -77.13 -43.98 32.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.923 179.119 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -76.27 53.61 0.83 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.91 -30.57 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.571 -179.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 12.1 m-85 -60.28 118.49 6.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.426 179.638 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -46.4 -46.62 18.69 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.237 0.541 . . . . 0.0 111.693 -179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.998 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.9 mp0 -50.84 -54.46 23.58 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.981 -179.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.793 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.19 -42.62 99.46 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.031 -0.268 . . . . 0.0 111.136 -179.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -34.7 40.58 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 110.148 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.559 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -75.75 -47.45 25.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.939 179.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 1.002 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.94 -41.73 62.28 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.088 0.47 . . . . 0.0 110.207 179.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.55 HD12 ' O ' ' A' ' 136' ' ' MET . 0.5 OUTLIER -78.69 -28.18 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.08 178.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.601 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -66.36 -52.02 51.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.019 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.05 -32.77 69.57 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.483 179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.475 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -57.07 -39.78 90.29 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.215 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.6 OUTLIER -80.4 -31.25 37.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.863 0.363 . . . . 0.0 110.588 179.652 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.3 tp-100 -64.54 -52.55 57.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.366 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.01 -53.55 48.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.927 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.592 ' CD2' HG12 ' A' ' 78' ' ' ILE . 86.8 mt -55.35 -39.79 70.48 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.921 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 14.5 t -60.75 -15.64 31.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.713 0.292 . . . . 0.0 110.888 179.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.63 -14.9 27.51 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.45 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.584 HD11 HD23 ' A' ' 147' ' ' LEU . 2.1 mt -81.69 -129.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 116.793 -0.185 . . . . 0.0 110.544 -179.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.591 ' O ' HD12 ' A' ' 153' ' ' LEU . 12.1 pt-20 -90.55 3.19 54.73 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -69.42 -11.41 60.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.586 0.231 . . . . 0.0 111.417 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.591 HD12 ' O ' ' A' ' 151' ' ' GLU . 1.3 mp . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.603 -0.271 . . . . 0.0 110.959 179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.56 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.577 ' O ' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.523 0.539 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 131.06 17.08 Favored 'Trans proline' 0 N--CA 1.446 -1.274 0 C-N-CA 124.338 3.359 . . . . 0.0 109.619 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.577 HD23 ' O ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -159.91 98.83 1.36 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.89 0.376 . . . . 0.0 111.067 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.54 134.75 1.73 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.54 -0.838 . . . . 0.0 112.541 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 4.3 t -67.45 139.31 57.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.824 0.345 . . . . 0.0 110.892 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.439 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 10.5 tpt -75.82 123.14 25.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.0 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 70.02 164.45 0.26 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.646 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.914 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -107.75 130.4 54.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.208 -0.906 . . . . 0.0 110.602 179.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.619 ' HB3' ' O ' ' A' ' 50' ' ' VAL . 0.0 OUTLIER -83.07 111.95 19.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.864 179.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.806 ' HB2' ' HD2' ' A' ' 94' ' ' LYS . . . -124.71 173.45 8.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.887 179.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.523 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 6.5 m -161.73 124.06 2.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.14 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -115.06 170.67 13.34 Favored Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.06 -0.816 . . . . 0.0 111.06 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.615 HD11 HD23 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -122.72 117.95 26.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.478 0.639 . . . . 0.0 111.687 -179.438 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.916 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.1 mt -82.24 91.17 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.638 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 177.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.916 HD11 HG23 ' A' ' 64' ' ' THR . 19.6 mt -79.57 143.23 12.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.833 -178.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.726 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 32.7 p90 -148.5 122.26 9.29 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.277 -178.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 103' ' ' VAL . 63.2 mtm180 -80.79 114.2 19.51 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.643 ' NH1' ' HB3' ' A' ' 152' ' ' ALA . 15.9 ttm180 -82.46 113.47 20.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.81 -178.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 19.5 p -72.36 160.62 32.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.544 179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 17.6 mt -59.72 -80.94 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.547 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.729 HD13 ' H ' ' A' ' 21' ' ' ILE . 0.2 OUTLIER -125.91 148.11 61.45 Favored Pre-proline 0 C--N 1.327 -0.388 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 36.4 Cg_exo -60.69 156.46 42.56 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.577 2.185 . . . . 0.0 112.344 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.95 -77.97 0.52 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.805 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 17.3 m -133.47 -37.55 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.327 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 164.61 25.41 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.695 179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -60.22 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.897 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 28' ' ' ALA . 2.2 m-80 -149.71 -29.78 0.24 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.806 0.336 . . . . 0.0 110.608 179.678 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 27' ' ' ASN . . . 70.07 -61.91 0.44 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.741 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.726 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 9.3 mt -102.27 151.13 5.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 121.411 0.624 . . . . 0.0 112.377 -178.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.664 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 41.8 mt-10 -135.33 139.69 44.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.422 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.599 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 57.9 m-85 -101.36 152.42 20.74 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -178.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.565 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 23.6 tp -85.17 138.59 32.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.931 179.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 43' ' ' TRP . 7.3 mt -138.37 136.22 36.12 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.502 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.703 HD11 ' HG3' ' A' ' 46' ' ' PRO . 13.6 mt -113.84 113.04 24.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.654 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 6.2 tp60 -66.12 126.6 29.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.76 0.314 . . . . 0.0 110.868 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.56 127.14 30.04 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.9 p -73.13 4.58 4.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.484 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -174.42 172.48 3.16 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-O 120.804 0.335 . . . . 0.0 110.433 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 99.36 -123.27 7.85 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.353 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.612 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.3 pt -99.24 9.46 7.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.498 0.19 . . . . 0.0 111.355 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.8 m-70 62.85 41.05 9.1 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-O 121.418 0.628 . . . . 0.0 109.483 -179.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.612 ' HB3' HD11 ' A' ' 40' ' ' ILE . 6.9 p-80 -88.21 163.43 16.14 Favored 'General case' 0 C--N 1.323 -0.543 0 CA-C-N 114.91 -1.041 . . . . 0.0 111.233 -179.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.664 ' HB3' HD22 ' A' ' 33' ' ' LEU . 77.0 m95 -112.81 120.31 41.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.532 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.581 ' HB ' ' HE3' ' A' ' 47' ' ' LYS . 0.9 OUTLIER -145.32 130.91 9.39 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.159 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 44' ' ' THR . 31.2 Cg_exo -58.49 175.95 0.48 Allowed 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.075 1.85 . . . . 0.0 111.594 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.721 ' CB ' ' HA ' ' A' ' 64' ' ' THR . 38.8 Cg_exo -57.78 105.02 0.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 122.501 2.134 . . . . 0.0 112.78 -179.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.581 ' HE3' ' HB ' ' A' ' 44' ' ' THR . 8.9 mtmp? -101.22 144.73 29.73 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.704 179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.463 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -122.82 -162.67 11.6 Favored Glycine 0 CA--C 1.518 0.244 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.564 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -137.54 96.0 3.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.94 0.4 . . . . 0.0 110.642 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.695 ' N ' HG21 ' A' ' 59' ' ' THR . 2.1 p -77.88 132.85 31.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.828 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.57 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -96.98 179.17 1.16 Allowed Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.107 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.57 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.1 Cg_exo -57.01 -59.06 0.69 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.145 1.897 . . . . 0.0 112.593 -179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -83.65 2.29 87.55 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.47 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.52 ' H ' ' HG2' ' A' ' 51' ' ' GLU . 9.7 tt0 -80.21 174.01 12.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.789 0.328 . . . . 0.0 110.6 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.858 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.7 t70 -94.39 153.77 17.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.216 0.532 . . . . 0.0 110.432 179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.603 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -72.14 -63.37 1.15 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.286 -179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.826 HD21 HG21 ' A' ' 77' ' ' ILE . 20.7 tp -63.97 -39.54 94.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.618 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.858 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.0 OUTLIER -50.76 -49.93 56.94 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.666 0.27 . . . . 0.0 110.745 -179.782 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.695 HG21 ' N ' ' A' ' 50' ' ' VAL . 55.5 m -54.03 -40.8 67.39 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.505 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -73.79 -28.73 61.8 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.3 178.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.709 HD22 ' HB2' ' A' ' 72' ' ' ALA . 90.1 mt -74.94 -53.49 8.91 Favored 'General case' 0 N--CA 1.462 0.138 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.75 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -59.81 -38.22 81.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.419 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.89 -36.11 82.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.023 0.44 . . . . 0.0 109.962 179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.916 HG23 HD11 ' A' ' 15' ' ' ILE . 14.0 m -60.13 -55.91 28.08 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.597 179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.571 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.9 pt20 -70.16 -22.11 63.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.868 179.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -79.06 -40.19 31.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.897 0.38 . . . . 0.0 110.785 179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' OE1' ' HA ' ' A' ' 46' ' ' PRO . 96.1 mt-10 -109.91 11.24 24.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.44 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.656 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -155.47 -6.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.51 0.31 16.75 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.383 -0.913 . . . . 0.0 112.819 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.763 HD11 ' CD1' ' A' ' 110' ' ' ILE . 2.7 mt -103.06 121.14 53.89 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-N 117.049 0.425 . . . . 0.0 110.48 179.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.4 pt-20 -108.66 173.27 6.39 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.09 0.471 . . . . 0.0 111.082 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.828 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.97 -37.58 32.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.381 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -70.36 -16.14 73.24 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.153 179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.512 ' C ' ' HE3' ' A' ' 104' ' ' LYS . 1.6 tp60 -102.49 -4.41 25.41 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 120.524 0.202 . . . . 0.0 111.261 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.828 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -134.39 -174.07 3.46 Favored 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.857 0.36 . . . . 0.0 110.219 178.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.556 ' H ' ' H ' ' A' ' 102' ' ' GLU . 51.4 m -130.48 100.96 5.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.29 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.826 HG21 HD21 ' A' ' 57' ' ' LEU . 14.7 mm -74.1 129.34 36.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.397 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.514 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -92.27 139.58 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.528 179.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -98.74 151.41 20.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.0 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.73 -26.42 24.15 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.453 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.611 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 11.1 t80 -104.3 127.35 51.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.017 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.465 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.4 ttpt -158.12 125.7 5.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.154 0.502 . . . . 0.0 111.662 179.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.71 139.91 25.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.551 179.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.896 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.7 OUTLIER -120.96 132.84 55.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.921 0.391 . . . . 0.0 111.429 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.922 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.8 mt -98.25 116.93 31.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.615 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.5 m-80 -107.22 125.38 51.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.378 -179.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.574 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 27.5 p90 -167.37 143.18 4.13 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.092 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.593 HG23 ' CA ' ' A' ' 92' ' ' LYS . 8.3 p -83.66 106.45 14.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.626 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.497 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -79.23 -101.44 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.837 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.424 ' O ' ' HB3' ' A' ' 91' ' ' ASN . 6.0 ptt180 -57.16 -41.41 79.15 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.828 0.347 . . . . 0.0 110.925 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.424 ' HB3' ' O ' ' A' ' 90' ' ' ARG . 6.6 p-10 172.55 29.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.376 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.912 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -157.73 128.96 3.75 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.292 -179.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.914 ' O ' HD12 ' A' ' 8' ' ' LEU . 40.8 Cg_endo -66.86 121.33 8.52 Favored 'Trans proline' 0 CA--C 1.514 -0.48 0 C-N-CA 123.287 2.658 . . . . 0.0 112.525 -179.415 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.806 ' HD2' ' HB2' ' A' ' 10' ' ' ALA . 0.1 OUTLIER -104.92 123.65 48.13 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.895 -178.63 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 97.4 m -91.24 106.31 18.41 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 177.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.725 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 21.6 t -108.5 108.46 25.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.896 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.58 127.54 40.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.658 ' HB3' HG13 ' A' ' 14' ' ' ILE . 17.0 m-85 -115.35 130.0 56.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 -177.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.603 ' HH2' ' HB3' ' A' ' 56' ' ' ASP . 15.0 m-90 -111.09 169.65 8.63 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.134 178.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.607 HD21 ' CD1' ' A' ' 81' ' ' PHE . 1.1 mt -102.95 112.32 25.09 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 178.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.563 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -121.34 151.2 40.38 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.697 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.556 ' H ' ' H ' ' A' ' 76' ' ' THR . 1.6 tt0 -125.88 112.24 15.75 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.414 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.768 HG12 HD23 ' A' ' 75' ' ' LEU . 5.0 m -72.07 112.92 8.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.148 0 CA-C-O 121.548 0.69 . . . . 0.0 110.79 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.512 ' HE3' ' C ' ' A' ' 74' ' ' GLN . 2.0 ptpt -58.01 -27.16 63.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.362 -0.836 . . . . 0.0 112.225 -178.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.899 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 16.2 m-20 -94.32 111.06 22.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.203 0.525 . . . . 0.0 111.593 -179.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.454 ' CE1' ' NH1' ' A' ' 17' ' ' ARG . 17.0 t80 -57.67 -39.99 78.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.422 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -103.86 27.34 7.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.715 178.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.899 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 4.6 p -46.9 151.53 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.21 -0.904 . . . . 0.0 111.749 -179.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.535 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 0.2 OUTLIER -76.8 144.75 38.93 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.294 0.568 . . . . 0.0 111.231 -179.396 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.875 HG21 ' CD1' ' A' ' 119' ' ' TYR . 44.9 mm -121.63 99.3 6.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.967 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.68 ' N ' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -98.77 101.83 13.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.926 -178.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.591 HD11 ' HD1' ' A' ' 119' ' ' TYR . 14.4 mt -95.94 140.41 30.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.73 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 67.7 p -83.08 -164.94 0.95 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.414 179.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -72.86 -4.53 32.38 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.501 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -91.47 -22.89 20.18 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.603 0.239 . . . . 0.0 111.426 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 94.2 m-70 -120.84 129.36 53.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.017 -179.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -98.74 -12.53 20.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.573 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.39 173.73 6.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.418 . . . . 0.0 111.436 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.875 ' CD1' HG21 ' A' ' 110' ' ' ILE . 46.8 p90 -146.68 174.64 11.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.578 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 49.7 mtt180 -156.12 153.6 29.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.261 0.553 . . . . 0.0 111.745 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.565 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 95.2 m95 -119.02 107.67 13.8 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.276 178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.673 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.2 167.42 21.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.021 0.439 . . . . 0.0 111.51 -178.654 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.67 -152.6 3.01 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.1 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' CD ' ' A' ' 141' ' ' GLN . 8.4 tp -77.25 -43.42 33.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.684 0.278 . . . . 0.0 111.292 179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.483 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.2 pt-20 -59.91 -48.08 83.14 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.665 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.892 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -73.28 -43.76 60.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.023 0.44 . . . . 0.0 111.055 -179.434 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.45 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -59.36 -29.82 67.95 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.361 0.601 . . . . 0.0 109.747 179.122 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.7 m -84.84 -33.71 22.82 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.49 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.892 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -66.67 -43.51 84.29 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.64 -179.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.586 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 2.2 mt -75.27 -45.73 38.05 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 127' ' ' ALA . . . -80.43 54.44 2.04 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-O 121.105 0.479 . . . . 0.0 109.865 178.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.0 -33.59 0.12 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.566 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.534 ' H ' ' HD1' ' A' ' 133' ' ' PHE . 4.4 m-85 -54.2 119.52 5.24 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.108 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -45.98 -47.72 16.61 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.302 0.572 . . . . 0.0 111.354 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.922 ' HB3' HD13 ' A' ' 85' ' ' LEU . 26.0 mp0 -49.66 -57.14 7.77 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.911 -179.261 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.451 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -62.14 -46.86 87.14 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.398 -179.058 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -49.02 -41.36 34.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.169 179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.532 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.97 -47.38 65.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.411 179.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.916 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.15 -41.98 63.01 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.38 179.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.45 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.4 OUTLIER -81.65 -28.19 33.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.119 178.816 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.532 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -66.63 -52.56 43.76 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.22 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.611 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -74.47 -25.37 59.36 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 -179.769 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.531 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.53 -47.64 88.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.472 -0.871 . . . . 0.0 111.771 179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.684 ' NE2' HD12 ' A' ' 29' ' ' ILE . 5.9 t-160 -76.08 -29.67 58.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.962 0.41 . . . . 0.0 110.655 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 12.7 tp-100 -68.95 -52.81 25.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -61.52 -47.57 85.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.856 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.611 HD23 HD11 ' A' ' 150' ' ' ILE . 65.0 mt -54.29 -44.48 71.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.593 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -67.6 -11.99 59.39 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.926 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.16 -13.69 26.44 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.439 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.611 HD11 HD23 ' A' ' 147' ' ' LEU . 1.5 mt -80.49 -130.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.609 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.424 ' O ' HD12 ' A' ' 153' ' ' LEU . 0.6 OUTLIER -95.28 -67.23 0.86 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.702 0.287 . . . . 0.0 111.17 -179.458 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.643 ' HB3' ' NH1' ' A' ' 18' ' ' ARG . . . -67.37 142.09 56.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.485 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.424 HD12 ' O ' ' A' ' 151' ' ' GLU . 5.9 mp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.835 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.574 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.576 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.483 0 N-CA-C 110.258 -1.137 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.36 -33.32 9.12 Favored 'Trans proline' 0 N--CA 1.448 -1.194 0 C-N-CA 124.354 3.369 . . . . 0.0 109.575 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.3 tp 61.97 91.85 0.06 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.832 0.349 . . . . 0.0 110.76 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -96.72 -40.91 3.73 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.54 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 81.0 p -81.18 109.84 16.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.682 0.277 . . . . 0.0 110.983 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.6 tpt -178.56 155.61 0.85 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.943 0.402 . . . . 0.0 111.015 179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.625 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 66.4 169.07 0.23 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.362 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.947 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.1 OUTLIER -111.09 138.66 47.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.01 179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.766 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -84.25 112.84 20.66 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.578 179.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.583 ' HB3' ' O ' ' A' ' 95' ' ' THR . . . -124.71 170.73 10.71 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.258 -179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 3.9 m -163.16 124.48 2.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.087 0.47 . . . . 0.0 111.115 179.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.639 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -118.52 177.61 16.5 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.583 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.654 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.4 OUTLIER -131.2 118.12 19.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 117.028 0.414 . . . . 0.0 111.762 -179.651 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.783 HD11 ' HB1' ' A' ' 139' ' ' ALA . 65.4 mt -82.73 92.08 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.014 HD11 HG23 ' A' ' 64' ' ' THR . 32.7 mt -83.73 145.16 8.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.444 -177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.744 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.8 p90 -152.2 122.47 7.21 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.284 -179.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.65 112.94 18.49 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.124 179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.7 OUTLIER -95.6 105.41 17.39 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.436 -179.474 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.39 160.81 18.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.714 179.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.51 -78.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.416 HD12 ' O ' ' A' ' 22' ' ' PRO . 2.8 pp -119.21 157.1 51.91 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.737 179.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.416 ' O ' HD12 ' A' ' 21' ' ' ILE . 52.1 Cg_exo -54.83 143.89 69.05 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.439 2.092 . . . . 0.0 112.414 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.5 OUTLIER -104.17 -81.87 0.51 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.065 -179.889 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.509 ' O ' HG12 ' A' ' 24' ' ' VAL . 6.1 t -103.4 6.3 10.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.758 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 64.96 34.32 9.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.839 0.352 . . . . 0.0 110.989 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -102.94 -58.33 1.89 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.162 0.506 . . . . 0.0 110.505 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -154.25 105.37 2.69 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.567 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.58 -33.69 58.47 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.35 -179.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.744 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.0 mt -115.12 146.44 19.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.239 0.542 . . . . 0.0 112.149 -179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.605 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 20.5 mt-10 -136.35 129.68 31.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.926 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.642 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 63.7 m-85 -91.64 150.01 21.36 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.184 0.439 . . . . 0.0 112.184 -178.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.62 HD23 HD12 ' A' ' 15' ' ' ILE . 55.1 tp -84.82 133.73 34.32 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -134.98 141.18 46.18 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.639 179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.603 HD11 ' HG3' ' A' ' 46' ' ' PRO . 14.4 mt -119.09 121.47 39.89 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.184 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.53 ' HG2' ' H ' ' A' ' 37' ' ' SER . 39.4 tt0 -61.42 162.48 7.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.59 179.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.499 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . . . -90.73 -10.98 40.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.795 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.53 ' H ' ' HG2' ' A' ' 35' ' ' GLN . 8.2 p 73.8 -59.4 0.56 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.77 0.319 . . . . 0.0 110.93 -179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -117.54 171.41 8.02 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.893 0.378 . . . . 0.0 110.917 -179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 77.41 -125.65 7.44 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.519 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.516 HG12 ' O ' ' A' ' 40' ' ' ILE . 12.7 tt -88.87 -2.68 9.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.499 ' HA ' ' HB3' ' A' ' 36' ' ' ALA . 2.3 m80 60.73 33.19 20.24 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.97 0.414 . . . . 0.0 110.519 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 46.4 p-80 -61.6 140.56 58.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.657 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.707 ' CZ3' ' HG3' ' A' ' 120' ' ' ARG . 40.8 m95 -101.66 119.79 39.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.989 -179.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.5 p -139.59 141.59 28.82 Favored Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.797 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.94 166.48 2.99 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.516 2.144 . . . . 0.0 112.09 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.78 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 24.3 Cg_exo -63.33 82.67 0.12 Allowed 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.751 2.301 . . . . 0.0 112.132 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.458 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 12.8 pttm -87.05 156.22 19.83 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.085 0.469 . . . . 0.0 111.335 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.23 -178.86 19.42 Favored Glycine 0 N--CA 1.45 -0.371 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.302 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.478 ' NE2' ' HB3' ' A' ' 8' ' ' LEU . 4.8 t-80 -108.49 118.69 37.43 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.766 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -93.06 134.79 29.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.256 0.55 . . . . 0.0 111.25 -179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.696 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 5.1 tt0 -93.52 152.06 40.63 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.878 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.5 Cg_endo -54.23 -22.04 24.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.644 2.23 . . . . 0.0 112.58 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.696 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.07 -14.35 36.56 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.795 178.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -83.06 168.15 17.2 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.66 0.267 . . . . 0.0 110.671 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 1.047 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 27.4 t70 -85.69 161.65 19.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.114 0.483 . . . . 0.0 110.747 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.52 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 0.5 OUTLIER -72.05 -63.71 1.08 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.501 -179.824 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.601 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 22.7 tp -66.66 -39.4 88.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.962 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 1.047 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 1.3 tt0 -49.69 -46.76 50.32 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.964 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.452 ' CB ' ' HB ' ' A' ' 50' ' ' VAL . 96.9 m -58.85 -47.59 84.33 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 179.082 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -65.75 -29.81 70.38 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.085 178.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.834 HD22 ' HB2' ' A' ' 72' ' ' ALA . 87.8 mt -72.18 -53.53 12.39 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.948 179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -64.02 -33.05 74.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.567 -179.85 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.95 -32.15 72.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.028 0.442 . . . . 0.0 109.844 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 1.014 HG23 HD11 ' A' ' 15' ' ' ILE . 23.1 m -60.46 -51.17 70.61 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.499 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.531 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -75.54 -20.6 58.57 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.07 179.673 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.3 tm-20 -78.32 -38.28 42.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.056 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.608 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 96.3 mt-10 -110.25 -0.66 17.68 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.8 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -141.37 -10.9 0.94 Allowed 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.647 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 75.26 -4.51 40.3 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.111 -1.042 . . . . 0.0 113.088 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.851 HD11 ' CD1' ' A' ' 110' ' ' ILE . 4.5 mt -100.71 126.95 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 CA-C-O 121.085 0.469 . . . . 0.0 111.278 -179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.512 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 8.0 pt-20 -109.96 170.44 8.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.786 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -46.98 -38.89 11.46 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.883 0.373 . . . . 0.0 111.039 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.95 -22.77 70.69 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.247 179.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.594 ' HG2' HG23 ' A' ' 70' ' ' ILE . 1.0 OUTLIER -98.67 -1.9 39.63 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 120.476 0.179 . . . . 0.0 111.244 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.876 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -136.95 -169.63 2.52 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.786 0.327 . . . . 0.0 110.201 178.148 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.589 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 24.4 m -136.34 99.68 4.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.609 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.597 HG21 HD21 ' A' ' 57' ' ' LEU . 8.4 mm -72.01 123.57 26.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.968 0.413 . . . . 0.0 111.009 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.515 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -86.87 139.23 17.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.777 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -98.75 151.7 20.48 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.097 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 102.1 -23.75 33.48 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.637 -0.792 . . . . 0.0 112.06 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.575 ' HE2' ' HB3' ' A' ' 142' ' ' GLU . 7.4 t80 -108.88 127.24 53.87 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.423 ' HG3' ' NE1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -159.01 127.79 5.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.214 0.53 . . . . 0.0 111.645 179.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.469 HH12 ' HG2' ' A' ' 142' ' ' GLU . 0.0 OUTLIER -153.81 141.52 20.0 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.851 179.099 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.862 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -121.86 132.53 54.62 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.178 -179.802 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.763 HD13 ' HB3' ' A' ' 135' ' ' GLU . 10.7 mt -94.54 118.74 32.15 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.351 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.415 HD22 ' HA ' ' A' ' 95' ' ' THR . 2.5 m120 -105.72 126.02 51.66 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.782 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 19.9 p90 -166.57 141.09 4.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.021 -179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.599 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.2 p -80.72 113.33 19.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.878 179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.528 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -76.19 -107.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.369 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -61.65 -42.35 98.78 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.964 0.411 . . . . 0.0 110.575 -179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -176.69 26.83 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.808 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.947 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -155.48 128.18 4.15 Favored Pre-proline 0 CA--C 1.534 0.347 0 CA-C-O 120.888 0.375 . . . . 0.0 111.06 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.761 ' O ' HD12 ' A' ' 8' ' ' LEU . 58.6 Cg_endo -72.22 116.0 4.54 Favored 'Trans proline' 0 CA--C 1.506 -0.895 0 C-N-CA 123.173 2.582 . . . . 0.0 112.404 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.668 ' HD3' ' CG2' ' A' ' 96' ' ' VAL . 0.9 OUTLIER -105.93 122.2 45.64 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.791 -179.205 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.583 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 22.9 m -79.47 120.27 23.64 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 178.678 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.708 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 9.5 t -115.0 108.72 26.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.815 -178.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.862 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.2 mm -86.42 133.59 29.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 178.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.716 ' HB3' HG13 ' A' ' 14' ' ' ILE . 77.6 m-85 -118.11 129.85 55.78 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.107 0.48 . . . . 0.0 111.743 -178.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 10.6 m-90 -117.47 139.57 50.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.934 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.496 HD12 HG21 ' A' ' 78' ' ' ILE . 1.1 mt -76.58 116.17 17.02 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.589 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -126.94 146.37 50.34 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 110.681 -179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.57 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 2.1 tm-20 -122.77 116.93 24.55 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.532 -0.303 . . . . 0.0 111.551 -179.523 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.742 HG12 HD23 ' A' ' 75' ' ' LEU . 12.9 m -73.12 120.65 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 121.371 0.605 . . . . 0.0 110.422 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -28.96 69.61 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.121 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.783 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 51.4 t0 -98.72 128.21 44.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.064 0.459 . . . . 0.0 111.978 -179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.56 -42.24 61.9 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.436 179.097 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -91.25 19.7 5.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.483 178.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.783 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.4 p -47.69 143.58 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.461 -0.791 . . . . 0.0 110.927 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.0 OUTLIER -66.35 142.55 57.59 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.468 0.652 . . . . 0.0 111.649 -178.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.851 ' CD1' HD11 ' A' ' 70' ' ' ILE . 40.1 mm -123.96 95.36 3.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 CA-C-N 115.087 -0.96 . . . . 0.0 109.953 179.129 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.647 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 12.3 mtp180 -95.22 101.34 13.07 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.727 -179.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.75 ' HB3' ' HB2' ' A' ' 116' ' ' HIS . 12.2 mt -95.42 151.88 18.89 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.86 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 43.3 m -81.38 -169.03 2.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.109 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.25 6.12 7.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.535 179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 60.0 tt0 -102.23 -32.11 10.23 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.612 0.244 . . . . 0.0 111.149 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.75 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.3 m80 -97.16 113.47 25.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.974 0.416 . . . . 0.0 111.078 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.518 ' HB2' ' CB ' ' A' ' 37' ' ' SER . 7.0 tp60 -76.19 -19.46 58.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.699 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -172.77 -177.12 1.6 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.23 0.538 . . . . 0.0 111.94 -179.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.709 ' CG ' HG21 ' A' ' 110' ' ' ILE . 36.3 p90 -151.01 162.73 40.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.509 -0.768 . . . . 0.0 109.992 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.707 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 0.3 OUTLIER -150.67 141.64 22.96 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.266 0.555 . . . . 0.0 111.681 179.516 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -98.79 107.64 20.13 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.222 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.719 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.09 168.31 19.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.814 -177.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -76.5 -152.02 4.17 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.832 -0.699 . . . . 0.0 111.599 179.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.469 HD21 ' HA ' ' A' ' 141' ' ' GLN . 6.7 tp -77.0 -40.94 44.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.826 0.346 . . . . 0.0 111.044 179.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 15.6 pt-20 -61.0 -51.18 70.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.866 -179.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.719 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -72.69 -32.97 66.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.086 0.469 . . . . 0.0 110.703 -179.334 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.533 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -69.91 -29.69 66.93 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.357 0.599 . . . . 0.0 109.497 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.6 m -84.43 -31.36 24.66 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.429 178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.682 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.7 OUTLIER -66.64 -45.51 78.78 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.782 -179.758 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.595 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.8 mt -74.09 -44.82 52.62 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 178.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -79.67 51.98 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.191 178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.488 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.1 -28.35 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.67 -179.494 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.52 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -58.11 117.41 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.405 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.523 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 1.2 tttm -46.06 -44.98 15.85 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 121.177 0.513 . . . . 0.0 111.778 -179.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.763 ' HB3' HD13 ' A' ' 85' ' ' LEU . 20.9 mp0 -53.47 -53.36 52.51 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.624 -179.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.498 ' CE ' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -61.97 -49.64 75.27 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.746 0.308 . . . . 0.0 111.394 -179.689 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.523 ' HZ2' ' HA ' ' A' ' 134' ' ' LYS . 0.0 OUTLIER -48.65 -39.61 24.92 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.11 179.656 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -71.88 -46.45 57.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.069 179.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.783 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.7 -41.47 66.98 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.161 0.505 . . . . 0.0 109.972 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.47 -27.93 41.54 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.174 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -67.01 -52.6 40.51 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.568 -179.58 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.575 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 2.4 mp0 -73.75 -25.48 60.19 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.572 -179.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.459 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -62.09 -43.12 99.59 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.378 -0.915 . . . . 0.0 111.108 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.462 ' NE2' HD12 ' A' ' 29' ' ' ILE . 4.8 t-80 -79.75 -31.92 41.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.027 0.442 . . . . 0.0 109.995 178.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . 0.405 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 13.6 tp60 -65.53 -50.88 63.56 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.743 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.42 ' CD1' HD11 ' A' ' 150' ' ' ILE . 49.7 t80 -63.16 -50.51 70.11 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.732 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.619 HD23 HD11 ' A' ' 150' ' ' ILE . 97.8 mt -55.67 -30.6 61.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.79 -179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.98 -18.83 60.82 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.691 179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.4 -9.86 40.14 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.422 -179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.619 HD11 HD23 ' A' ' 147' ' ' LEU . 1.0 OUTLIER -86.17 -130.38 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.436 179.704 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.423 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 0.6 OUTLIER -172.79 -68.22 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.937 0.398 . . . . 0.0 110.571 -179.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 151' ' ' GLU . . . 176.39 177.36 0.25 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.837 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.782 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.593 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.805 ' N ' ' HD2' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.523 0.544 0 N-CA-C 110.276 -1.13 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.805 ' HD2' ' N ' ' A' ' 1' ' ' GLY . 82.4 Cg_endo -72.45 29.43 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.22 0 C-N-CA 124.298 3.332 . . . . 0.0 109.59 179.4 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.517 ' H ' ' C ' ' A' ' 1' ' ' GLY . 0.4 OUTLIER -59.87 125.69 24.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.709 0.29 . . . . 0.0 110.946 -179.778 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.455 ' N ' HD13 ' A' ' 3' ' ' LEU . . . -153.19 -120.72 0.82 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.573 -179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 10.9 p -59.51 129.17 40.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.557 0.218 . . . . 0.0 111.019 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 6' ' ' MET . 0.9 OUTLIER -62.36 100.8 0.19 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.853 0.359 . . . . 0.0 110.535 179.782 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.665 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 52.47 173.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.265 0.555 . . . . 0.0 110.993 -179.739 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.895 HD12 ' O ' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -117.92 140.31 49.9 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.809 178.839 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.702 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -84.56 133.11 34.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.748 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.453 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -150.66 166.34 30.65 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.596 179.281 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 96.4 m -155.25 124.59 6.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.916 0.388 . . . . 0.0 111.515 179.542 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.627 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -112.06 172.59 14.89 Favored Glycine 0 N--CA 1.452 -0.292 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 178.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.61 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.6 OUTLIER -127.14 117.76 23.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.294 0.547 . . . . 0.0 111.487 -179.931 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.94 HD11 ' HB1' ' A' ' 139' ' ' ALA . 74.3 mt -84.03 91.53 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 178.038 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.802 HD11 HG23 ' A' ' 64' ' ' THR . 10.3 mt -83.11 146.2 7.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 114.948 -1.024 . . . . 0.0 111.172 -178.501 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.753 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.6 p90 -151.82 122.95 7.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.961 -178.755 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.771 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -80.83 111.64 17.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 178.949 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -86.64 108.51 18.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.0 110.806 -179.705 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t -99.74 151.54 21.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.867 -179.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.724 ' O ' HG23 ' A' ' 21' ' ' ILE . 1.3 pt? -57.45 -45.61 84.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.0 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.724 HG23 ' O ' ' A' ' 20' ' ' LEU . 1.3 pp -173.7 155.16 2.49 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.716 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -66.95 149.01 82.94 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.644 2.23 . . . . 0.0 112.39 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.632 ' HB2' HD21 ' A' ' 26' ' ' ASN . 0.0 OUTLIER -103.35 -80.79 0.52 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.422 179.331 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 2.7 m -134.86 -39.7 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.778 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -135.81 45.83 2.38 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.561 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.632 HD21 ' HB2' ' A' ' 23' ' ' LYS . 0.9 OUTLIER -161.32 117.24 2.15 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.116 179.492 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -67.84 -170.45 0.16 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.723 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.9 -72.58 0.24 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.417 -179.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.753 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 11.2 mt -99.58 147.83 6.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.376 0.607 . . . . 0.0 111.866 -179.17 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.554 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 15.7 mt-10 -136.74 122.94 20.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.088 179.306 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.625 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 62.6 m-85 -87.39 141.91 28.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.934 -178.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.56 ' HB2' ' CH2' ' A' ' 121' ' ' TRP . 38.3 tp -79.97 133.61 36.19 Favored 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 7.3 mt -136.65 137.0 39.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.538 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.562 HD22 HD22 ' A' ' 112' ' ' LEU . 12.6 mt -113.8 125.9 54.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.985 -179.533 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.561 ' HG3' ' CE2' ' A' ' 43' ' ' TRP . 2.1 tt0 -57.82 168.61 0.88 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.394 179.753 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.71 -26.04 22.02 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.126 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.734 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 2.8 p 78.77 -15.87 0.72 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.868 179.781 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -158.63 -169.1 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 110.365 -0.235 . . . . 0.0 110.365 179.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 57.97 -120.22 20.6 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.614 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.526 HG12 ' O ' ' A' ' 40' ' ' ILE . 11.9 tt -91.08 -1.91 10.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.635 0.255 . . . . 0.0 111.358 -179.793 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 63.56 26.41 14.71 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.001 0.429 . . . . 0.0 110.751 -179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 29.9 p-80 -60.52 159.38 10.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.842 179.803 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.577 ' O ' HG23 ' A' ' 44' ' ' THR . 50.6 m95 -111.7 135.6 52.08 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.021 -179.915 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.577 HG23 ' O ' ' A' ' 43' ' ' TRP . 6.6 p -160.95 147.72 11.79 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.671 179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.439 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 23.8 Cg_endo -61.36 169.44 6.51 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.574 2.183 . . . . 0.0 112.202 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.472 ' CG ' ' HA ' ' A' ' 64' ' ' THR . 63.6 Cg_endo -75.54 108.59 2.73 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.798 2.332 . . . . 0.0 112.388 -179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.627 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 5.0 pttp -106.36 141.15 38.16 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.002 0.43 . . . . 0.0 111.295 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.456 ' CA ' ' HB2' ' A' ' 63' ' ' ALA . . . -110.83 -161.74 17.77 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.964 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -130.04 105.12 7.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.773 0.32 . . . . 0.0 110.765 -179.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.702 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.7 OUTLIER -78.22 113.93 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-O 121.295 0.569 . . . . 0.0 110.976 -179.783 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.653 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -74.52 177.99 1.93 Allowed Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.578 -179.919 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.653 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 42.3 Cg_exo -56.84 -50.04 12.76 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.338 2.026 . . . . 0.0 112.771 -179.518 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -96.06 12.88 66.67 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.908 -179.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -86.5 167.29 14.78 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.994 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 5.3 t70 -92.21 158.71 16.0 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.87 -0.418 . . . . 0.0 109.87 179.18 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.47 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 2.9 m-20 -73.08 -61.46 1.81 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.304 -179.419 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.679 HD13 ' CD2' ' A' ' 99' ' ' TRP . 17.9 tp -63.2 -39.78 95.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.69 0.281 . . . . 0.0 110.935 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.994 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.6 OUTLIER -49.84 -50.78 44.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.858 0.361 . . . . 0.0 110.862 -179.897 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.58 HG21 ' N ' ' A' ' 50' ' ' VAL . 56.3 m -55.63 -41.49 73.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 179.456 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.59 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -72.25 -30.32 64.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.996 178.357 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.75 HD22 ' HB2' ' A' ' 72' ' ' ALA . 95.9 mt -72.76 -52.25 15.81 Favored 'General case' 0 CA--C 1.523 -0.082 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.272 179.133 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.47 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.58 -40.65 95.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.811 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.456 ' HB2' ' CA ' ' A' ' 48' ' ' GLY . . . -60.31 -36.5 78.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.802 HG23 HD11 ' A' ' 15' ' ' ILE . 85.5 m -59.78 -58.07 10.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.855 179.299 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.556 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 2.7 pt20 -68.91 -21.8 64.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.145 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.47 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 22.5 mt-10 -79.03 -42.87 25.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.853 0.358 . . . . 0.0 110.958 179.654 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.58 ' O ' HD23 ' A' ' 112' ' ' LEU . 1.8 mp0 -103.79 1.78 32.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.742 -179.623 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.627 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -144.54 -5.87 0.73 Allowed 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 112.338 0.495 . . . . 0.0 112.338 -179.804 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 68.7 -1.59 9.61 Favored Glycine 0 CA--C 1.522 0.494 0 C-N-CA 120.141 -1.028 . . . . 0.0 112.811 -179.842 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.736 ' O ' HG22 ' A' ' 64' ' ' THR . 1.6 mt -103.06 125.07 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.178 0 CA-C-O 121.022 0.439 . . . . 0.0 110.308 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 13.0 pt-20 -111.38 173.55 6.29 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.741 -179.619 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.826 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.42 -38.27 28.54 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.629 179.402 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -65.71 -14.46 60.57 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.449 179.073 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -106.98 -15.44 14.7 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.821 0.311 . . . . 0.0 111.453 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.833 HD23 HG12 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -123.65 -175.13 3.14 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-O 120.939 0.399 . . . . 0.0 110.449 178.623 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.546 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 43.0 m -129.27 100.76 5.71 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.094 -179.58 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.672 HG21 HD21 ' A' ' 57' ' ' LEU . 13.2 mm -72.82 115.09 13.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.762 179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.474 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.1 mp -75.91 136.01 25.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.59 -179.692 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.8 mt-10 -93.76 151.61 19.5 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.338 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.24 -23.51 35.61 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.292 -179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.757 ' CD1' HD21 ' A' ' 100' ' ' LEU . 11.7 t80 -107.29 127.03 53.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.789 0.328 . . . . 0.0 111.174 -179.997 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 5.6 ttpt -158.72 125.12 4.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.011 179.637 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.92 145.05 31.39 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.085 179.403 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.83 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.9 OUTLIER -126.17 126.38 44.01 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.944 -0.303 . . . . 0.0 111.224 179.852 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.009 HD13 ' HB3' ' A' ' 135' ' ' GLU . 4.7 mt -90.68 120.06 31.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.877 0.37 . . . . 0.0 110.454 179.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 1.9 m-80 -110.47 124.22 51.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 -179.499 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.627 ' CG ' ' N1 ' ' A' ' 154' ' ' ATP . 18.3 p90 -166.87 137.85 3.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.966 0.412 . . . . 0.0 111.126 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.569 HG23 ' CA ' ' A' ' 92' ' ' LYS . 7.8 p -76.33 113.8 15.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.345 0.593 . . . . 0.0 110.889 179.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.479 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -79.82 -105.56 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.819 -178.72 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.456 ' O ' ' HB2' ' A' ' 91' ' ' ASN . 1.6 ptt-85 -63.45 -35.92 82.02 Favored 'General case' 0 N--CA 1.456 -0.175 0 CA-C-O 120.978 0.418 . . . . 0.0 110.394 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 90' ' ' ARG . 9.6 t-20 176.28 27.11 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.969 179.77 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.794 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -156.27 128.04 3.87 Favored Pre-proline 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 0.0 110.981 -179.968 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.895 ' O ' HD12 ' A' ' 8' ' ' LEU . 44.0 Cg_endo -70.18 118.69 5.83 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.422 2.748 . . . . 0.0 113.099 -179.226 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.862 ' HG2' HD13 ' A' ' 8' ' ' LEU . 6.2 mmmt -99.26 130.2 45.54 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.144 -179.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.422 HG23 HD21 ' A' ' 86' ' ' ASN . 17.8 m -95.6 107.16 19.33 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 177.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.748 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 44.8 t -107.13 108.0 24.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.789 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.83 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -86.13 128.71 39.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.519 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.577 ' HB3' HG13 ' A' ' 14' ' ' ILE . 10.6 m-85 -108.54 163.25 13.39 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.334 0.588 . . . . 0.0 111.439 -178.83 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.679 ' CD2' HD13 ' A' ' 57' ' ' LEU . 2.8 m-90 -150.75 136.23 17.93 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.172 179.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.757 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.4 OUTLIER -76.97 114.6 15.94 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 179.11 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.546 ' HA ' ' O ' ' A' ' 76' ' ' THR . . . -125.86 151.46 46.82 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-O 120.749 0.309 . . . . 0.0 111.305 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.527 ' H ' ' H ' ' A' ' 76' ' ' THR . 0.3 OUTLIER -124.86 113.35 17.77 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.163 -179.598 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.833 HG12 HD23 ' A' ' 75' ' ' LEU . 10.5 m -71.92 122.83 25.06 Favored 'Isoleucine or valine' 0 C--N 1.338 0.07 0 CA-C-O 121.171 0.51 . . . . 0.0 110.323 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 104' ' ' LYS . 2.1 mttt -65.26 -21.55 66.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.98 -178.12 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.815 ' HB2' ' HB ' ' A' ' 108' ' ' VAL . 5.9 m-20 -102.67 113.15 26.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.221 0.534 . . . . 0.0 111.624 -179.048 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.424 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 13.4 t80 -58.56 -38.33 77.61 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.237 179.739 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -103.24 23.3 12.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.548 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.815 ' HB ' ' HB2' ' A' ' 105' ' ' ASP . 7.1 p -42.99 148.83 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.826 -179.529 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.694 ' HG3' ' HD3' ' A' ' 111' ' ' ARG . 15.5 pm0 -73.22 141.76 47.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.273 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.711 ' CD1' HD11 ' A' ' 70' ' ' ILE . 36.6 mm -120.43 105.19 16.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.634 179.086 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.694 ' HD3' ' HG3' ' A' ' 109' ' ' GLU . 0.0 OUTLIER -103.38 97.44 7.5 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.59 -179.241 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.659 HD11 ' HD1' ' A' ' 119' ' ' TYR . 3.3 mt -95.75 144.46 26.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.357 179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 115' ' ' GLU . 2.7 p -94.06 -169.36 2.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.606 -179.979 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . 0.501 ' H ' ' CD2' ' A' ' 114' ' ' HIS . 4.4 p80 -67.55 10.84 0.15 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -179.689 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.422 ' H ' ' C ' ' A' ' 113' ' ' SER . 5.4 mt-10 -100.88 -30.48 11.65 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.72 0.295 . . . . 0.0 110.887 179.431 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.406 ' ND1' ' HB2' ' A' ' 34' ' ' LEU . 26.1 m-70 -124.78 124.0 41.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.889 0.376 . . . . 0.0 110.942 -179.896 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.734 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 0.0 OUTLIER -82.47 -17.57 44.77 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.5 -179.932 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -163.46 -176.56 4.78 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.241 0.544 . . . . 0.0 111.507 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.678 ' CE2' HG13 ' A' ' 110' ' ' ILE . 31.9 p90 -153.59 172.38 17.29 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.325 -179.589 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 20.9 mtt85 -157.9 157.87 33.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.118 0.485 . . . . 0.0 111.03 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.56 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 83.5 m95 -122.31 107.06 11.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.382 178.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.668 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -135.82 165.09 26.42 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 0.0 111.567 -178.402 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -70.53 -154.14 1.21 Allowed Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.819 179.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 141' ' ' GLN . 8.8 tp -76.73 -43.67 36.42 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.836 0.35 . . . . 0.0 110.745 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 19.5 pt-20 -57.36 -51.63 68.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.614 -179.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.668 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -69.62 -53.08 20.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.811 0.338 . . . . 0.0 110.244 -179.887 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.459 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -51.04 -27.41 7.93 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 178.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.442 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.5 OUTLIER -82.69 -35.25 26.96 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.511 178.392 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -63.55 -43.81 95.99 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.5 -179.642 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.606 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 0.5 OUTLIER -77.91 -39.77 41.87 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.265 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.433 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -80.03 47.8 0.92 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.135 179.285 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.454 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.19 -29.34 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.726 -179.861 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.458 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 4.6 m-85 -59.69 119.83 8.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.421 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -46.46 -46.24 18.77 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.218 0.532 . . . . 0.0 111.847 -179.051 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 1.009 ' HB3' HD13 ' A' ' 85' ' ' LEU . 23.1 mp0 -52.7 -56.39 15.84 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.893 -178.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.496 ' HE3' ' HA ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -59.43 -41.0 88.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.571 0.224 . . . . 0.0 111.446 -179.347 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.59 -42.3 64.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.851 0.357 . . . . 0.0 110.103 179.455 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.575 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -68.11 -47.62 67.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.608 179.394 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.94 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -51.34 -49.1 62.07 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.92 0.391 . . . . 0.0 110.206 179.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 136' ' ' MET . 0.6 OUTLIER -74.36 -26.81 60.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.319 178.887 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.06 -52.72 32.07 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.095 -179.818 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.412 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 3.1 mm-40 -68.79 -29.17 67.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.264 179.778 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.438 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.71 -48.46 84.83 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.854 179.379 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.457 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 0.3 OUTLIER -74.55 -28.95 61.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.887 0.375 . . . . 0.0 110.743 179.579 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 145' ' ' GLN . 8.1 tp60 -68.35 -51.46 44.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.481 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.564 ' CD2' HD11 ' A' ' 150' ' ' ILE . 71.0 t80 -65.43 -51.21 61.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.996 0.427 . . . . 0.0 110.953 -179.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.499 ' HA ' HG13 ' A' ' 150' ' ' ILE . 93.9 mt -56.33 -32.29 64.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.899 -179.845 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 4.2 t -75.98 -14.03 60.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.86 0.362 . . . . 0.0 110.714 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.41 -9.66 23.18 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.784 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.564 HD11 ' CD2' ' A' ' 146' ' ' PHE . 0.9 OUTLIER -83.4 -132.6 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.611 -179.99 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 7.9 tm-20 -147.94 -69.77 0.23 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.881 0.372 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -155.24 -77.45 0.1 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.095 179.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.745 179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.627 ' N1 ' ' CG ' ' A' ' 87' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.571 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.523 0 N-CA-C 110.259 -1.136 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.571 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 84.2 Cg_endo -72.34 12.78 0.6 Allowed 'Trans proline' 0 N--CA 1.447 -1.209 0 C-N-CA 124.288 3.325 . . . . 0.0 109.629 -179.593 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.453 ' H ' ' C ' ' A' ' 1' ' ' GLY . 0.1 OUTLIER 61.15 90.27 0.07 Allowed 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.851 0.358 . . . . 0.0 110.823 -179.916 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -126.66 -36.08 0.53 Allowed Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.736 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 2.4 m -59.45 98.47 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.848 0.356 . . . . 0.0 111.271 -179.664 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.401 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.4 OUTLIER -88.28 132.33 34.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.254 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.646 ' HB1' ' O ' ' A' ' 93' ' ' PRO . . . 64.21 178.16 0.17 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.204 0.526 . . . . 0.0 111.003 -179.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.972 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -114.18 131.26 56.51 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.354 178.49 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.3 OUTLIER -82.89 132.39 35.16 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.673 -178.907 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.681 ' HB2' ' HE3' ' A' ' 94' ' ' LYS . . . -145.1 163.22 34.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.507 179.456 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 56.7 m -154.52 124.31 6.65 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.029 0.443 . . . . 0.0 111.732 -179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -117.26 171.49 13.87 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.235 -0.746 . . . . 0.0 111.235 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.534 HD11 HD23 ' A' ' 61' ' ' LEU . 0.9 OUTLIER -122.57 117.89 26.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.28 0.54 . . . . 0.0 112.44 -179.174 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.826 HD11 ' HB1' ' A' ' 139' ' ' ALA . 54.2 mt -80.73 92.12 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.505 -0.781 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.287 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.867 HD11 HG23 ' A' ' 64' ' ' THR . 27.2 mt -84.4 146.88 6.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.251 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.706 -178.035 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.78 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 52.6 p90 -153.88 121.15 5.76 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.288 -179.385 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' CG ' ' HB2' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -79.74 114.42 18.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 178.518 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.465 ' H ' ' CG ' ' A' ' 102' ' ' GLU . 0.5 OUTLIER -102.89 126.71 50.15 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.127 -179.112 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.78 159.23 19.8 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.435 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 23.0 tp -58.67 -85.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.659 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.624 HD11 ' HE3' ' A' ' 23' ' ' LYS . 2.8 pp -115.94 148.73 41.95 Favored Pre-proline 0 C--N 1.332 -0.174 0 CA-C-O 120.654 0.264 . . . . 0.0 110.9 179.458 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -62.62 153.23 73.18 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.543 2.162 . . . . 0.0 112.541 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.624 ' HE3' HD11 ' A' ' 21' ' ' ILE . 0.7 OUTLIER -132.16 -73.44 0.52 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.336 179.964 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 24' ' ' VAL . 23.3 t -72.33 -7.0 8.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.395 -179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 63.25 21.05 12.63 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.282 . . . . 0.0 110.885 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -88.78 -78.19 0.35 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.519 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -121.36 -167.01 1.44 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.185 179.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -158.1 -50.5 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.959 0.409 . . . . 0.0 111.19 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.78 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.7 mt -111.14 141.11 27.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.056 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.673 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 4.1 mt-10 -133.89 127.25 32.15 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.046 179.102 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.678 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.2 m-85 -87.09 154.37 20.8 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.5 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.643 HD23 HD12 ' A' ' 15' ' ' ILE . 39.2 tp -90.73 135.01 33.99 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.843 178.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 127' ' ' ALA . 5.9 mt -135.11 142.02 46.13 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.757 -179.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 112' ' ' LEU . 14.5 mt -121.81 107.42 12.29 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.855 -179.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HB2' ' CD2' ' A' ' 43' ' ' TRP . 37.3 tt0 -67.71 141.77 56.52 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.04 157.37 25.42 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.191 179.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.518 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 78.8 p -90.16 2.85 54.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.61 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -174.07 177.42 2.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.835 0.35 . . . . 0.0 110.93 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 81.31 -131.92 10.78 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.652 -0.785 . . . . 0.0 112.121 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 40' ' ' ILE . 12.1 tt -82.59 -2.69 6.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 120.906 0.384 . . . . 0.0 110.892 179.562 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 61.61 27.67 17.06 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 179.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -60.43 148.9 35.78 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 120.849 0.357 . . . . 0.0 110.549 179.638 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.697 ' O ' HG23 ' A' ' 44' ' ' THR . 37.5 m95 -98.11 150.1 21.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.035 179.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.77 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -171.54 144.02 1.56 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.524 -179.728 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.484 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 32.8 Cg_exo -61.56 165.63 13.1 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.356 2.037 . . . . 0.0 112.171 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -61.12 102.07 0.2 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.484 2.123 . . . . 0.0 112.443 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.5 mtmp? -87.92 155.44 19.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.907 179.911 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.511 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -138.13 174.29 22.0 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.206 179.828 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -115.81 103.53 10.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.677 179.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.666 ' N ' HG21 ' A' ' 59' ' ' THR . 1.4 p -81.3 127.37 39.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.302 0.572 . . . . 0.0 111.363 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.0 tt0 -88.46 153.24 50.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.291 179.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 12.5 Cg_endo -55.57 -18.74 21.07 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.985 2.456 . . . . 0.0 112.585 -179.525 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.632 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -107.54 -6.67 32.99 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.926 179.213 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -88.75 176.48 7.06 Favored 'General case' 0 C--N 1.333 -0.138 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.925 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 14.5 t70 -92.7 161.41 14.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.029 0.442 . . . . 0.0 109.991 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.471 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 24.3 m-20 -73.7 -61.06 1.97 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.849 -179.099 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.652 ' HA ' ' CZ3' ' A' ' 99' ' ' TRP . 36.6 tp -65.91 -40.01 91.11 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.74 0.305 . . . . 0.0 110.831 179.999 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.925 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.15 -47.15 54.43 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.79 179.708 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.666 HG21 ' N ' ' A' ' 50' ' ' VAL . 85.1 m -58.0 -43.6 86.72 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -69.94 -32.7 71.11 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.019 178.755 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.929 HD22 ' HB2' ' A' ' 72' ' ' ALA . 91.2 mt -71.11 -51.77 23.18 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.491 179.322 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HD2' ' HG3' ' A' ' 66' ' ' GLU . 0.2 OUTLIER -61.78 -41.03 97.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.011 -179.816 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -62.22 -34.78 77.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.163 0.506 . . . . 0.0 110.24 179.419 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.867 HG23 HD11 ' A' ' 15' ' ' ILE . 93.5 m -60.08 -51.39 69.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.434 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.535 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 7.0 pt20 -76.85 -21.81 54.46 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.515 179.48 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HG3' ' HD2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -78.27 -35.03 48.59 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.739 0.304 . . . . 0.0 110.73 179.193 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.604 ' O ' ' HA ' ' A' ' 112' ' ' LEU . 2.0 mp0 -108.18 -14.24 14.75 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -129.5 -8.79 4.63 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.691 0.281 . . . . 0.0 111.632 179.837 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.973 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.54 -8.65 25.91 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.236 179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.795 HG23 ' HG2' ' A' ' 74' ' ' GLN . 3.2 mt -94.22 123.4 46.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.883 0.373 . . . . 0.0 111.012 -179.677 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.4 pm0 -103.54 169.38 8.57 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.023 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.929 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -45.89 -39.13 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.364 179.719 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.95 -23.02 74.32 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.382 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.795 ' HG2' HG23 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -95.76 1.39 53.29 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.726 0.298 . . . . 0.0 111.324 -179.994 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.866 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -137.69 -166.41 1.95 Allowed 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 177.692 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -140.57 98.52 3.43 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.559 0.219 . . . . 0.0 111.03 -179.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.57 HG13 HD21 ' A' ' 61' ' ' LEU . 9.4 mm -73.24 114.2 12.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.074 0.464 . . . . 0.0 111.778 -179.848 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.667 HG21 HD12 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -77.05 138.13 21.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.62 179.322 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -97.52 148.82 22.86 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.403 -179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 104.93 -24.64 27.7 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.12 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.674 ' CE2' ' HB3' ' A' ' 142' ' ' GLU . 12.1 t80 -104.35 127.43 52.01 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 120.836 0.35 . . . . 0.0 111.146 -179.842 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.521 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER -158.94 128.19 5.49 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.261 0.553 . . . . 0.0 111.31 179.577 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 9.4 tpt85 -154.53 137.86 15.79 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.95 179.294 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.844 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.9 pm0 -120.83 136.13 54.99 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.169 0.509 . . . . 0.0 111.455 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.96 HD13 ' HB3' ' A' ' 135' ' ' GLU . 7.6 mt -95.24 118.21 31.61 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.168 179.163 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.621 HD21 HG23 ' A' ' 95' ' ' THR . 1.9 m-80 -108.34 126.3 52.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.735 -179.261 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.588 ' CE2' ' C6 ' ' A' ' 154' ' ' ATP . 7.4 p90 -167.0 141.0 3.79 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.161 -179.633 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.661 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.9 p -80.7 113.57 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.53 0.681 . . . . 0.0 110.64 179.294 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.752 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -68.61 -102.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.352 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.432 HH11 ' HB3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER -77.48 -35.01 54.14 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 120.964 0.412 . . . . 0.0 110.312 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -172.89 16.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.603 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.819 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -148.6 126.38 5.76 Favored Pre-proline 0 N--CA 1.451 -0.384 0 CA-C-O 120.945 0.402 . . . . 0.0 111.365 -179.616 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.836 ' O ' HD12 ' A' ' 8' ' ' LEU . 50.6 Cg_endo -69.06 118.71 5.84 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 123.615 2.877 . . . . 0.0 113.234 -179.52 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.972 ' HG2' HD13 ' A' ' 8' ' ' LEU . 4.6 mmmt -101.39 124.76 47.58 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.331 -179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.621 HG23 HD21 ' A' ' 86' ' ' ASN . 27.2 m -89.4 114.93 26.45 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 177.567 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.719 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 37.5 t -113.52 108.03 24.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.759 -178.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.844 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.4 mm -86.35 132.5 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.695 ' HB3' HG13 ' A' ' 14' ' ' ILE . 43.0 m-85 -118.66 129.97 55.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.126 0.488 . . . . 0.0 111.656 -178.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.652 ' CZ3' ' HA ' ' A' ' 57' ' ' LEU . 1.1 m-90 -118.47 142.62 47.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.387 179.47 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.667 HD12 HG21 ' A' ' 78' ' ' ILE . 1.5 mt -76.07 123.09 25.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 179.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' ' 15' ' ' ILE . . . -133.85 134.39 42.71 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.441 -179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.63 ' HB2' ' CE2' ' A' ' 16' ' ' PHE . 1.4 tt0 -114.78 115.15 26.56 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.182 -179.533 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.804 HG12 HD23 ' A' ' 75' ' ' LEU . 16.6 m -72.05 108.29 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-O 121.547 0.689 . . . . 0.0 110.143 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -57.07 -13.04 2.48 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.974 -178.774 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.2 t0 -107.87 116.6 32.24 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 121.012 0.434 . . . . 0.0 111.347 -179.768 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -65.59 -38.96 90.99 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.323 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.39 25.74 6.69 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.511 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.1 p -51.37 146.33 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.919 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.87 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.1 pm0 -74.12 145.84 44.01 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.065 -179.357 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.794 HD13 HD11 ' A' ' 70' ' ' ILE . 32.7 mm -122.47 101.22 9.47 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.951 179.389 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.973 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 0.3 OUTLIER -102.11 97.03 7.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.095 -179.468 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.896 HD22 HD22 ' A' ' 34' ' ' LEU . 6.1 mt -90.03 150.53 22.06 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.801 179.742 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 8.2 t -83.86 -168.13 2.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.593 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -74.09 1.58 10.79 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.552 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -98.83 -29.14 13.14 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.845 0.355 . . . . 0.0 110.817 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.591 ' HB2' ' HB3' ' A' ' 112' ' ' LEU . 30.6 m80 -109.11 110.81 22.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.769 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.518 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 12.9 pt20 -89.53 -6.73 56.1 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.842 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -170.61 152.62 3.89 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.107 0.48 . . . . 0.0 111.838 -179.729 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.725 ' CE2' HG13 ' A' ' 110' ' ' ILE . 32.7 p90 -133.23 175.81 9.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.306 179.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.607 ' HB2' ' CZ3' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -157.54 166.32 33.24 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.368 0.604 . . . . 0.0 111.798 179.801 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.407 ' CE3' ' HG2' ' A' ' 17' ' ' ARG . 83.5 m95 -131.01 106.75 8.6 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 114.957 -1.02 . . . . 0.0 109.335 178.751 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.761 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.1 OUTLIER -137.38 170.17 16.54 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.205 0.526 . . . . 0.0 111.518 -178.441 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -74.71 -153.26 3.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.706 179.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.438 HD21 ' NE2' ' A' ' 141' ' ' GLN . 8.5 tp -77.23 -41.26 41.9 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.989 0.423 . . . . 0.0 111.264 179.724 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 17.6 pt-20 -61.25 -50.93 71.07 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.488 -179.566 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.761 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -71.65 -40.57 69.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.403 -179.347 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.648 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -62.25 -32.42 73.11 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 124' ' ' LEU . 1.8 m -82.19 -31.13 30.54 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.569 179.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.726 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 1.2 pp0? -67.23 -44.75 78.72 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.011 -179.64 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.624 HD22 ' CE2' ' A' ' 43' ' ' TRP . 1.8 mt -74.71 -46.19 39.19 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.429 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -77.66 51.65 0.93 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.296 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.476 ' H ' ' HG2' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -39.18 -26.99 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.88 -179.326 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.653 ' HB3' ' OE1' ' A' ' 135' ' ' GLU . 3.2 m-85 -61.03 119.43 8.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.413 179.994 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.448 ' HA ' ' HZ2' ' A' ' 137' ' ' LYS . 0.1 OUTLIER -44.89 -46.75 11.06 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.078 0.466 . . . . 0.0 111.87 -179.02 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.96 ' HB3' HD13 ' A' ' 85' ' ' LEU . 13.1 mp0 -52.46 -54.49 31.65 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.827 -178.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.77 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -62.61 -41.37 98.94 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -178.595 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -55.77 -34.49 65.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.685 0.278 . . . . 0.0 110.344 179.729 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.514 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -74.79 -43.75 53.1 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.471 179.544 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.826 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -56.41 -45.54 80.62 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.302 179.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.648 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.5 OUTLIER -75.58 -26.41 57.89 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.991 178.138 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.514 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.4 -52.06 37.15 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.31 0.576 . . . . 0.0 110.533 179.867 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.674 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 4.5 mm-40 -69.9 -28.99 66.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.861 -179.594 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -58.29 -47.98 86.33 Favored Glycine 0 C--N 1.33 0.235 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.313 179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.491 ' CE1' ' HB ' ' A' ' 29' ' ' ILE . 0.9 OUTLIER -75.21 -33.08 61.35 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.984 0.421 . . . . 0.0 110.342 179.587 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . 0.423 ' OE1' ' HA ' ' A' ' 145' ' ' GLN . 4.4 tp60 -63.31 -51.88 64.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.716 -179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -61.93 -50.48 71.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.739 179.815 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.595 ' HA ' ' CD1' ' A' ' 150' ' ' ILE . 69.9 mt -59.48 -34.11 72.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 14.1 t -74.02 -20.02 60.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.724 179.36 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.19 -10.49 41.51 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.937 -179.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.595 ' CD1' ' HA ' ' A' ' 147' ' ' LEU . 0.2 OUTLIER -86.86 -130.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.166 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -178.05 -78.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.73 0.3 . . . . 0.0 110.816 179.611 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -74.42 156.81 36.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.913 0.387 . . . . 0.0 110.968 179.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 153' ' ' LEU . 9.5 mt . . . . . 0 C--N 1.331 -0.204 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.741 179.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.752 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.521 0 N-CA-C 110.264 -1.134 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -72.44 101.52 1.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.207 0 C-N-CA 124.328 3.352 . . . . 0.0 109.555 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.9 -40.69 3.11 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.982 0.42 . . . . 0.0 110.657 -179.948 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.19 -83.16 0.35 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.491 179.881 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 6.3 m -83.13 102.58 11.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.783 0.325 . . . . 0.0 110.918 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.405 ' CE ' ' HB2' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -72.61 126.66 30.42 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.667 179.844 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.668 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 57.82 168.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.381 0.61 . . . . 0.0 111.49 179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.075 HD13 ' HG2' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -109.39 138.87 45.11 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.52 179.801 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.8 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.1 OUTLIER -79.11 128.52 33.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.984 -179.981 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.82 161.07 39.6 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.013 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 20.8 m -157.14 123.47 4.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.162 0.506 . . . . 0.0 111.212 179.602 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.534 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.49 170.85 13.66 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.483 178.79 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.467 HD12 ' OG1' ' A' ' 64' ' ' THR . 0.3 OUTLIER -122.73 118.15 27.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.049 0.425 . . . . 0.0 111.669 -179.42 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.778 HD11 ' HB1' ' A' ' 139' ' ' ALA . 56.1 mt -83.01 91.22 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.432 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.128 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.004 HD11 HG23 ' A' ' 64' ' ' THR . 29.6 mt -81.15 145.29 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.049 -178.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.713 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 46.2 p90 -151.91 121.19 6.77 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 116.141 -0.481 . . . . 0.0 112.016 -178.866 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.469 ' CD ' ' HA ' ' A' ' 106' ' ' TYR . 8.9 ttp180 -76.67 118.02 18.88 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.3 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.617 HH11 ' HB2' ' A' ' 18' ' ' ARG . 0.1 OUTLIER -93.59 116.24 28.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.946 -178.378 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.83 160.64 14.15 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.488 179.767 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 tp -68.77 -85.51 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.163 -179.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.45 ' H ' HG13 ' A' ' 21' ' ' ILE . 2.7 pp -112.26 158.49 36.95 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-O 120.7 0.286 . . . . 0.0 111.619 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.09 147.9 51.27 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.657 2.238 . . . . 0.0 112.105 179.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.63 -79.2 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.665 179.966 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 10.4 m -133.12 -41.43 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.269 0.556 . . . . 0.0 110.931 179.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 176.24 32.82 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.628 179.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.41 -77.98 0.47 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.013 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -175.93 -178.85 1.08 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.834 179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.14 -53.41 2.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.07 -179.855 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.713 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 7.3 mt -107.61 154.9 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.114 0.483 . . . . 0.0 111.772 -179.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.612 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 5.5 mp0 -138.37 127.32 23.94 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.121 179.659 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.649 ' CD1' ' HB3' ' A' ' 16' ' ' PHE . 55.2 m-85 -91.35 146.68 23.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.955 0.407 . . . . 0.0 112.036 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.646 HD23 HD12 ' A' ' 15' ' ' ILE . 43.5 tp -81.88 132.68 35.28 Favored 'General case' 0 CA--C 1.52 -0.189 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 178.652 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.499 HD11 ' HA ' ' A' ' 127' ' ' ALA . 7.5 mt -133.14 142.74 48.83 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.968 0.413 . . . . 0.0 110.791 -179.637 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 112' ' ' LEU . 17.2 mt -121.81 104.2 9.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.535 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 43' ' ' TRP . 3.8 tt0 -64.56 134.07 53.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.271 -179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.43 139.56 55.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.408 179.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.765 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 69.3 p -77.6 12.18 1.75 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.742 -179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -179.21 -171.5 0.21 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.659 0.266 . . . . 0.0 110.455 179.661 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 80.89 -122.98 5.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.245 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.802 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.0 OUTLIER -96.76 8.7 6.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.641 0.258 . . . . 0.0 111.343 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 61.8 36.82 15.94 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-O 121.337 0.589 . . . . 0.0 109.911 -178.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.802 ' HB3' HD11 ' A' ' 40' ' ' ILE . 3.8 p-80 -79.35 155.2 28.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.996 -1.002 . . . . 0.0 111.211 -179.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.595 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 71.6 m95 -104.59 137.9 41.74 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.296 -179.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 43' ' ' TRP . 0.7 OUTLIER -160.5 136.68 6.23 Favored Pre-proline 0 CA--C 1.53 0.175 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.985 -179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -62.02 178.78 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.405 2.07 . . . . 0.0 111.656 179.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.506 ' HG3' HD11 ' A' ' 34' ' ' LEU . 50.9 Cg_exo -56.31 98.12 0.07 OUTLIER 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.437 2.091 . . . . 0.0 112.644 -179.649 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -97.97 129.31 44.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.773 179.716 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -146.47 140.74 8.97 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.701 179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 5.8 p80 -76.29 127.23 32.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.663 0.268 . . . . 0.0 110.798 179.701 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.8 HG13 ' HB3' ' A' ' 9' ' ' ARG . 0.9 OUTLIER -88.72 137.32 21.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.984 0.421 . . . . 0.0 110.582 179.634 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.666 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 3.0 tt0 -89.72 152.12 46.48 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.614 -179.572 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.532 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 10.4 Cg_endo -55.25 -22.91 34.7 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.524 2.149 . . . . 0.0 112.971 -179.179 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.666 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -99.42 -11.83 43.57 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.383 179.238 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -88.05 158.64 18.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.603 0.24 . . . . 0.0 110.63 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.915 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 16.8 t0 -77.73 163.42 26.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.995 0.426 . . . . 0.0 110.22 179.788 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -70.87 -61.37 1.79 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.906 -179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.649 HD21 HG21 ' A' ' 77' ' ' ILE . 22.0 tp -64.32 -41.7 96.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.145 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.915 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 2.1 mt-10 -51.19 -45.15 61.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.687 -179.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.584 HG21 ' HB ' ' A' ' 50' ' ' VAL . 82.4 m -58.21 -40.91 82.85 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.149 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.534 ' HB1' ' O ' ' A' ' 12' ' ' GLY . . . -72.49 -30.62 64.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.905 178.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 96.0 mt -72.62 -52.47 15.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.421 179.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 66' ' ' GLU . 0.0 OUTLIER -61.48 -41.02 96.61 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.804 -179.659 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 46' ' ' PRO . . . -60.45 -33.64 72.86 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.147 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 1.004 HG23 HD11 ' A' ' 15' ' ' ILE . 24.5 m -60.14 -58.26 9.28 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.412 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.484 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -70.18 -20.31 63.13 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.621 179.47 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.492 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 1.4 tm-20 -79.06 -39.86 32.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.125 179.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.414 ' O ' ' CD2' ' A' ' 112' ' ' LEU . 10.3 mm-40 -106.38 -5.3 19.11 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.934 -179.309 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 64' ' ' THR . . . -138.46 -11.76 1.38 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 -179.525 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.687 ' HA3' ' HD3' ' A' ' 111' ' ' ARG . . . 76.38 -3.85 51.9 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.857 -1.164 . . . . 0.0 112.85 -179.67 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.789 HD11 ' CD1' ' A' ' 110' ' ' ILE . 5.0 mt -99.01 121.79 50.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.53 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 5.2 pm0 -105.11 171.06 7.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.523 0.202 . . . . 0.0 111.208 -179.387 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.897 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -48.93 -31.7 7.78 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.698 179.921 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -73.89 -23.85 75.46 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.317 -0.944 . . . . 0.0 111.857 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.548 ' HB3' HG23 ' A' ' 70' ' ' ILE . 2.5 tp60 -95.03 3.85 54.42 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.813 0.339 . . . . 0.0 110.921 179.655 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.897 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -141.48 -169.25 2.83 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 178.289 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 101' ' ' ALA . 86.3 m -137.23 100.3 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.364 -179.671 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.649 HG21 HD21 ' A' ' 57' ' ' LEU . 10.1 mm -71.59 126.92 32.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.96 179.74 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.535 HG12 ' CD2' ' A' ' 147' ' ' LEU . 1.2 mp -90.02 137.69 20.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.062 0.458 . . . . 0.0 111.07 -179.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -97.85 149.95 21.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.397 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.21 -27.1 21.49 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.352 179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.896 ' CD1' HD21 ' A' ' 100' ' ' LEU . 15.0 t80 -105.03 126.02 51.61 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.733 0.301 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.51 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -157.57 124.56 5.06 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.257 0.551 . . . . 0.0 111.524 179.976 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -150.76 140.71 21.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.464 179.053 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.959 ' HB3' HD13 ' A' ' 97' ' ' ILE . 4.0 pm0 -121.19 138.26 54.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.05 0.452 . . . . 0.0 111.771 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.797 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.4 mt -98.87 116.91 32.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.622 179.457 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' A' ' 94' ' ' LYS . 2.1 p30 -113.86 125.66 54.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.5 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 10.1 p90 -166.67 146.25 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.572 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.622 HG23 ' CA ' ' A' ' 92' ' ' LYS . 9.9 p -82.37 110.71 17.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.332 179.561 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.844 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -80.78 -95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.627 -179.066 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.472 ' HD3' ' HB2' ' A' ' 91' ' ' ASN . 0.0 OUTLIER -67.28 -41.17 85.93 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.872 0.368 . . . . 0.0 110.655 -179.923 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.499 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 0.5 OUTLIER 178.12 26.6 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.278 179.766 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.81 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -157.48 129.94 4.24 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.447 179.591 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.911 ' O ' HD12 ' A' ' 8' ' ' LEU . 56.5 Cg_endo -70.07 119.58 6.48 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.208 2.605 . . . . 0.0 112.998 -179.195 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 1.075 ' HG2' HD13 ' A' ' 8' ' ' LEU . 7.4 mmmt -104.3 121.9 44.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.047 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.457 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 30.0 m -87.94 116.81 26.37 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.619 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.686 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 38.1 t -115.81 108.9 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.859 -178.114 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.959 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.6 mm -86.0 126.63 40.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.374 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.636 ' HB3' HG13 ' A' ' 14' ' ' ILE . 13.8 m-85 -113.27 133.25 55.2 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.085 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.636 ' CD2' HD13 ' A' ' 57' ' ' LEU . 9.3 m-90 -117.83 141.43 48.43 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.949 178.566 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.896 HD21 ' CD1' ' A' ' 81' ' ' PHE . 0.3 OUTLIER -78.07 115.65 17.96 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.791 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.601 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -124.55 144.4 50.15 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.16 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.458 ' HA ' ' O ' ' A' ' 16' ' ' PHE . 1.3 tt0 -123.1 116.38 23.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.81 0.338 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.733 HG12 HD23 ' A' ' 75' ' ' LEU . 11.2 m -73.22 115.01 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 121.431 0.634 . . . . 0.0 110.705 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.532 ' HD3' ' C ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -62.17 -11.95 17.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.607 -179.188 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.812 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 66.9 t0 -114.12 121.55 44.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.619 179.278 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.469 ' HA ' ' CD ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -70.59 -47.47 60.01 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-O 121.581 0.705 . . . . 0.0 109.456 179.687 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -85.03 16.49 3.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.057 178.491 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.812 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 6.8 p -46.14 144.53 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.153 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.101 179.909 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.508 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 0.6 OUTLIER -66.82 143.95 56.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.587 0.708 . . . . 0.0 111.755 -179.033 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.866 HG21 ' CD1' ' A' ' 119' ' ' TYR . 42.0 mm -123.45 99.8 7.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 114.81 -1.087 . . . . 0.0 110.222 179.37 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.687 ' HD3' ' HA3' ' A' ' 69' ' ' GLY . 23.8 mtp180 -102.13 103.08 13.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.332 -178.658 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.676 HD22 HD22 ' A' ' 34' ' ' LEU . 11.3 mt -98.85 135.6 40.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -180.0 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.38 -164.88 0.69 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.113 179.343 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 14.4 0.92 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 179.681 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -104.62 -36.15 7.58 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.843 0.354 . . . . 0.0 110.886 179.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.407 ' CD2' ' HB3' ' A' ' 67' ' ' GLU . 75.3 m-70 -113.31 115.68 28.53 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.607 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.765 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 1.6 pt20 -86.93 -14.36 42.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.827 -179.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -160.05 153.11 21.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.07 0.462 . . . . 0.0 112.131 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.866 ' CD1' HG21 ' A' ' 110' ' ' ILE . 45.0 p90 -133.19 171.41 14.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.168 179.702 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.42 ' HD2' ' CH2' ' A' ' 43' ' ' TRP . 3.6 mtt180 -157.37 160.3 38.31 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.213 0.53 . . . . 0.0 111.846 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.477 ' CH2' ' HB2' ' A' ' 32' ' ' LEU . 92.2 m95 -124.21 107.67 11.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.791 179.227 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.696 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -139.47 168.49 19.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.925 0.393 . . . . 0.0 111.942 -178.303 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -73.73 -153.94 2.96 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.998 179.59 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 141' ' ' GLN . 12.4 tp -77.33 -41.6 39.9 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.828 0.347 . . . . 0.0 111.119 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.6 pt-20 -61.43 -50.23 73.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.619 -179.449 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.833 ' HA ' ' HG2' ' A' ' 129' ' ' GLN . 0.3 OUTLIER -70.93 -45.8 63.59 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.87 0.366 . . . . 0.0 110.531 -179.47 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.499 ' HA ' HD11 ' A' ' 33' ' ' LEU . . . -56.89 -30.46 63.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.29 0.567 . . . . 0.0 109.802 179.174 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . . . . . . . . . 9.7 m -84.38 -31.98 24.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.271 178.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.833 ' HG2' ' HA ' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -65.01 -43.79 91.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 -179.872 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.647 ' N ' ' HG3' ' A' ' 129' ' ' GLN . 1.1 mt -77.72 -42.55 33.94 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.954 179.281 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.439 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.2 53.5 1.24 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.19 -32.14 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 114.885 -1.052 . . . . 0.0 111.876 -178.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.538 ' CD2' ' C5 ' ' A' ' 154' ' ' ATP . 40.9 m-85 -59.74 120.75 10.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.308 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 4.7 tttp -46.32 -52.27 13.07 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.301 0.572 . . . . 0.0 111.26 -179.453 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.797 ' HB3' HD13 ' A' ' 85' ' ' LEU . 15.9 mp0 -43.6 -54.39 4.99 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.829 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.667 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -66.39 -34.06 77.12 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.872 0.368 . . . . 0.0 110.584 -179.498 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 131' ' ' ALA . 0.0 OUTLIER -59.91 -35.32 74.62 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.408 179.545 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -78.42 -45.29 22.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.794 179.7 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.778 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -52.84 -55.38 23.48 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.114 179.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.667 HD12 ' O ' ' A' ' 136' ' ' MET . 0.8 OUTLIER -63.8 -27.56 69.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.455 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.529 ' HB2' ' HA ' ' A' ' 138' ' ' ALA . 0.0 OUTLIER -68.99 -51.77 35.96 Favored 'General case' 0 N--CA 1.456 -0.164 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.029 -179.9 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.588 ' HB3' ' HE2' ' A' ' 81' ' ' PHE . 71.1 mm-40 -71.26 -30.96 66.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.597 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.442 ' O ' ' HG ' ' A' ' 147' ' ' LEU . . . -58.32 -47.63 88.45 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.651 179.105 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.506 ' O ' ' HB2' ' A' ' 148' ' ' CYS . 29.8 t-80 -74.58 -31.69 62.14 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.803 0.335 . . . . 0.0 110.435 179.192 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -64.68 -53.2 51.06 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.348 -179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . . . . . . . . . 14.8 t80 -62.16 -48.9 78.02 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.747 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.719 HD23 HD11 ' A' ' 150' ' ' ILE . 79.3 mt -60.91 -26.99 67.86 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.532 -179.783 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 144' ' ' HIS . 1.7 t -76.04 -17.13 59.79 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.782 0.325 . . . . 0.0 110.792 179.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 2.0 m -92.46 -12.49 31.93 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.598 -179.766 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.719 HD11 HD23 ' A' ' 147' ' ' LEU . 0.0 OUTLIER -91.29 -133.72 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 179.808 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.482 ' H ' ' HB ' ' A' ' 150' ' ' ILE . 1.0 OUTLIER -165.28 -72.63 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.956 0.408 . . . . 0.0 110.136 179.698 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . 53.34 17.01 0.96 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.525 . . . . 0.0 112.186 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.834 -0.167 . . . . 0.0 111.033 -179.937 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.844 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.764 ' N ' ' CD ' ' A' ' 2' ' ' PRO . . . . . . . . 0 CA--C 1.522 0.507 0 N-CA-C 110.272 -1.131 . . . . 0.0 110.272 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.764 ' CD ' ' N ' ' A' ' 1' ' ' GLY . 82.4 Cg_endo -72.36 24.88 0.27 Allowed 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 124.328 3.352 . . . . 0.0 109.619 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.514 ' H ' ' C ' ' A' ' 1' ' ' GLY . 2.8 mp -115.87 16.22 16.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.309 -179.847 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 178.85 93.45 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.516 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.96 158.78 27.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 0.0 110.887 179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.46 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 2.3 ptm -168.61 -178.36 3.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.753 -179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.51 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 69.54 172.52 0.3 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.062 0.458 . . . . 0.0 111.351 179.942 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.801 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -118.22 137.19 53.19 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.309 179.565 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.867 ' HB3' HG13 ' A' ' 50' ' ' VAL . 0.0 OUTLIER -86.65 115.74 24.31 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.146 -179.665 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.492 ' HB2' ' HG2' ' A' ' 94' ' ' LYS . . . -126.84 174.59 8.67 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.651 179.39 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.679 ' HB3' ' HB2' ' A' ' 60' ' ' ALA . 9.7 m -164.04 124.91 2.21 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.164 0.507 . . . . 0.0 111.186 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.672 ' O ' ' HB1' ' A' ' 60' ' ' ALA . . . -117.94 175.88 15.9 Favored Glycine 0 N--CA 1.448 -0.522 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.789 HD11 HD23 ' A' ' 61' ' ' LEU . 1.2 mt -128.99 119.4 24.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 117.466 0.633 . . . . 0.0 112.693 -178.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.572 HD11 ' HB3' ' A' ' 98' ' ' TYR . 14.2 mm -77.0 91.61 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.572 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 177.225 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.987 HD11 HG23 ' A' ' 64' ' ' THR . 58.7 mt -88.01 141.83 13.77 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.601 -178.287 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.814 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 54.8 p90 -152.23 122.42 7.16 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -179.116 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 17' ' ' ARG . 9.2 ptt85 -83.69 114.31 21.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.993 0.425 . . . . 0.0 110.251 179.31 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 6.6 ttm-85 -101.62 112.36 24.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.95 -179.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.02 160.32 8.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.554 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 13.9 mt -46.62 -56.4 6.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.73 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -152.1 154.25 32.22 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.031 179.419 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.48 ' O ' ' HE2' ' A' ' 23' ' ' LYS . 28.0 Cg_exo -61.88 156.94 45.88 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.697 2.265 . . . . 0.0 112.18 179.589 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.48 ' HE2' ' O ' ' A' ' 22' ' ' PRO . 1.7 mmpt? -132.33 -81.19 0.5 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.759 0.314 . . . . 0.0 111.163 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.5 ' O ' HG12 ' A' ' 24' ' ' VAL . 19.9 t -93.66 -3.87 10.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.623 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 67.83 32.8 5.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.916 0.389 . . . . 0.0 110.822 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -89.54 -68.59 0.77 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.138 -179.714 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -145.08 98.58 3.19 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.691 179.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -86.94 -47.75 8.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.668 -179.116 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.824 ' HB ' ' HE2' ' A' ' 144' ' ' HIS . 4.1 mt -106.29 143.54 17.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.113 -179.05 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.751 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 0.6 OUTLIER -137.28 132.94 34.43 Favored 'General case' 0 C--O 1.223 -0.294 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.244 179.45 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.66 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 45.0 m-85 -94.75 143.52 26.38 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.072 0.463 . . . . 0.0 112.233 -178.682 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.652 HD21 ' CB ' ' A' ' 68' ' ' ALA . 50.0 tp -79.59 132.87 36.39 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.339 179.434 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.572 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 5.7 mt -135.04 140.71 45.82 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.648 179.833 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 112' ' ' LEU . 8.7 mt -117.86 123.79 46.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.163 -178.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.495 ' OE1' ' CZ2' ' A' ' 43' ' ' TRP . 1.2 tt0 -68.59 151.71 46.36 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.135 -179.414 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.45 ' O ' ' HB3' ' A' ' 37' ' ' SER . . . -83.24 -12.11 57.11 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.873 ' HA ' ' HG2' ' A' ' 117' ' ' GLN . 44.4 t 72.22 -60.17 0.54 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.477 0.18 . . . . 0.0 111.306 -179.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -110.8 -174.49 2.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.836 0.351 . . . . 0.0 110.896 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.3 -132.73 33.15 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.287 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 40' ' ' ILE . 9.3 tt -82.29 1.02 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 CA-C-O 120.648 0.261 . . . . 0.0 111.434 -179.897 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 19.4 m-70 61.33 24.11 14.26 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.787 0.327 . . . . 0.0 111.162 179.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 41.8 p-80 -60.38 148.14 38.24 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.884 179.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.507 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 26.8 m95 -103.05 110.31 22.18 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.386 179.733 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.644 ' HB ' ' HE2' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -126.91 128.47 24.21 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.778 -179.323 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.573 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 49.2 Cg_exo -55.9 168.18 1.93 Allowed 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.326 2.017 . . . . 0.0 112.493 179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.65 ' HB3' ' HB2' ' A' ' 67' ' ' GLU . 15.2 Cg_endo -59.79 101.04 0.14 Allowed 'Trans proline' 0 CA--C 1.528 0.193 0 C-N-CA 123.148 2.565 . . . . 0.0 112.875 -179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.644 ' HE2' ' HB ' ' A' ' 44' ' ' THR . 4.7 mtmt -103.52 129.57 50.73 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-O 120.852 0.358 . . . . 0.0 111.093 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.55 ' HA3' ' HB2' ' A' ' 63' ' ' ALA . . . -111.13 -179.37 20.25 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.345 179.744 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -120.02 104.84 10.48 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.745 0.307 . . . . 0.0 110.69 179.692 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.867 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.6 p -76.2 129.04 37.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-O 121.042 0.449 . . . . 0.0 111.193 -179.138 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.667 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 0.4 OUTLIER -92.4 177.01 2.28 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.539 -179.596 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.667 ' HD2' ' HG3' ' A' ' 51' ' ' GLU . 35.0 Cg_exo -57.42 -60.25 0.45 Allowed 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.684 2.256 . . . . 0.0 112.72 -178.992 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.54 0.13 88.41 Favored Glycine 0 CA--C 1.517 0.167 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.694 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.606 ' HB2' ' HG2' ' A' ' 51' ' ' GLU . 17.6 tt0 -78.73 171.98 14.38 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 179.35 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 7.4 t70 -98.6 158.69 15.44 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.208 0.527 . . . . 0.0 110.056 178.896 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.556 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . 0.4 OUTLIER -70.14 -63.95 0.98 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.755 -179.074 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.601 HD13 ' CD2' ' A' ' 99' ' ' TRP . 33.1 tp -65.2 -39.04 92.3 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.668 0.27 . . . . 0.0 111.223 179.979 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.998 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.3 OUTLIER -49.1 -45.38 43.26 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.665 179.675 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.551 HG21 ' N ' ' A' ' 50' ' ' VAL . 66.6 m -59.83 -48.62 80.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.33 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.679 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -64.64 -28.02 69.33 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.158 178.694 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.876 HD22 ' HB2' ' A' ' 72' ' ' ALA . 93.2 mt -76.35 -51.67 11.46 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.25 179.147 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -63.08 -35.18 79.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.231 179.657 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.55 ' HB2' ' HA3' ' A' ' 48' ' ' GLY . . . -65.72 -38.23 88.61 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.269 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.987 HG23 HD11 ' A' ' 15' ' ' ILE . 56.2 m -56.15 -51.21 68.8 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.593 179.133 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.471 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 18.2 pt20 -76.03 -21.97 56.26 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.961 179.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.429 ' HB2' ' HA ' ' A' ' 63' ' ' ALA . 0.9 OUTLIER -75.9 -35.89 59.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.214 179.635 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.65 ' HB2' ' HB3' ' A' ' 46' ' ' PRO . 2.8 mm-40 -112.04 -4.99 14.33 Favored 'General case' 0 N--CA 1.462 0.166 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.652 ' CB ' HD21 ' A' ' 32' ' ' LEU . . . -136.92 -6.65 1.87 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 179.697 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.548 ' HA3' ' CD ' ' A' ' 111' ' ' ARG . . . 72.94 -7.73 9.11 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.219 -0.991 . . . . 0.0 113.804 179.484 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.737 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.0 OUTLIER -96.6 129.14 47.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-O 121.005 0.431 . . . . 0.0 111.161 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 3.9 pt-20 -110.63 170.2 8.25 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.634 -179.682 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.876 ' HB2' HD22 ' A' ' 61' ' ' LEU . . . -46.13 -36.3 5.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.156 179.452 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -67.87 -24.04 74.27 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.53 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.493 ' HB3' HG23 ' A' ' 70' ' ' ILE . 5.8 mm100 -97.1 -4.04 40.14 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 122.676 -0.308 . . . . 0.0 111.485 -179.673 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -131.59 -170.93 2.48 Favored 'General case' 0 C--N 1.334 -0.083 0 CA-C-O 120.898 0.38 . . . . 0.0 110.257 178.128 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.569 ' H ' ' H ' ' A' ' 102' ' ' GLU . 34.6 m -133.65 100.06 4.67 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.605 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.603 ' HA ' ' O ' ' A' ' 100' ' ' LEU . 12.2 mm -72.26 113.11 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.732 -179.608 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.766 ' HB ' ' HB2' ' A' ' 100' ' ' LEU . 1.2 mp -73.49 144.95 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.845 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -100.17 148.96 24.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.205 -179.65 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 100.1 -17.44 57.09 Favored Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.699 -0.763 . . . . 0.0 112.714 179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.512 ' CD2' HD11 ' A' ' 100' ' ' LEU . 30.5 t80 -100.3 102.45 13.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.866 0.365 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -126.02 135.59 51.97 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.004 0.431 . . . . 0.0 110.42 179.366 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 0.2 OUTLIER -163.56 145.93 9.75 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.574 179.962 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.924 ' HB3' HD13 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -136.15 116.43 13.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.983 0.421 . . . . 0.0 111.908 179.88 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.92 HD13 ' HB3' ' A' ' 135' ' ' GLU . 6.9 mt -77.73 119.17 20.87 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.956 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -112.82 119.98 39.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.862 -179.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' CD1' ' C2 ' ' A' ' 154' ' ' ATP . 7.8 p90 -167.28 144.34 4.52 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.258 -179.974 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.628 ' HA ' ' HA ' ' A' ' 93' ' ' PRO . 9.2 p -81.84 115.38 24.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 121.416 0.627 . . . . 0.0 110.387 179.156 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.764 ' HB1' " C4'" ' A' ' 154' ' ' ATP . . . -72.72 -98.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.938 -178.309 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.43 ' HB2' HH11 ' A' ' 90' ' ' ARG . 0.0 OUTLIER -78.39 -35.55 47.09 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.099 179.853 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.564 ' O ' ' HE2' ' A' ' 92' ' ' LYS . 1.1 m-20 -174.6 18.61 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.359 179.616 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.801 ' HB3' HD11 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -150.77 128.39 5.67 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-O 120.992 0.425 . . . . 0.0 110.883 -179.94 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.735 ' O ' HD12 ' A' ' 8' ' ' LEU . 60.3 Cg_endo -74.09 118.32 5.35 Favored 'Trans proline' 0 CA--C 1.509 -0.768 0 C-N-CA 123.397 2.732 . . . . 0.0 112.973 -179.293 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.492 ' HG2' ' HB2' ' A' ' 10' ' ' ALA . 4.5 ttpt -101.53 121.82 42.68 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.168 -179.373 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.1 m -86.69 108.06 18.49 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 178.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.71 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 30.0 t -105.92 108.19 24.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.741 -0.384 . . . . 0.0 111.706 -178.591 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.924 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -85.92 124.75 40.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.31 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.572 ' HB3' HD11 ' A' ' 14' ' ' ILE . 35.9 m-85 -110.72 130.83 55.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.847 -178.203 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.601 ' CD2' HD13 ' A' ' 57' ' ' LEU . 6.3 m-90 -116.49 150.54 37.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.783 178.43 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.766 ' HB2' ' HB ' ' A' ' 78' ' ' ILE . 26.2 mt -78.89 132.88 36.94 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' PHE . . . -139.98 140.96 36.41 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.994 -179.043 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.569 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.4 tt0 -123.91 113.43 18.48 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.751 179.42 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.831 HG12 HD23 ' A' ' 75' ' ' LEU . 17.1 m -72.21 110.23 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-O 121.416 0.627 . . . . 0.0 110.396 179.64 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.481 ' HD3' ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -58.56 -13.48 5.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.918 -179.038 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.716 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 65.0 t0 -108.26 114.76 28.88 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.025 0.441 . . . . 0.0 111.526 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.42 ' CE1' ' CD ' ' A' ' 17' ' ' ARG . 0.5 OUTLIER -61.91 -42.54 99.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.121 179.357 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -96.58 25.23 5.26 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.103 179.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.716 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 7.7 p -49.33 147.28 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.575 -0.738 . . . . 0.0 111.347 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.444 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 1.7 pm0 -72.43 142.73 48.66 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 121.321 0.581 . . . . 0.0 110.822 -179.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.858 HG21 ' CG ' ' A' ' 119' ' ' TYR . 44.4 mm -121.48 98.69 6.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.065 -179.762 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.548 ' CD ' ' HA3' ' A' ' 69' ' ' GLY . 0.0 OUTLIER -98.99 101.89 13.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.531 -179.169 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 34' ' ' LEU . 4.5 mt -92.07 160.81 15.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.016 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.21 -170.82 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.649 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -66.34 -34.67 78.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.324 -179.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -75.19 -6.4 49.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.591 -179.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.582 ' CB ' ' HB3' ' A' ' 112' ' ' LEU . 3.1 m-70 -110.93 127.86 55.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.756 0.313 . . . . 0.0 111.131 -179.671 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.873 ' HG2' ' HA ' ' A' ' 37' ' ' SER . 1.4 pp0? -99.41 -23.2 15.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.068 179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.4 -177.57 2.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 111.956 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.858 ' CG ' HG21 ' A' ' 110' ' ' ILE . 40.7 p90 -147.44 169.51 19.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.186 -179.955 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.443 ' HG3' ' CZ3' ' A' ' 43' ' ' TRP . 96.5 mtt180 -153.89 154.72 34.39 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.236 0.541 . . . . 0.0 111.63 -179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -119.31 107.06 12.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.468 178.698 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.72 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -137.28 169.31 18.0 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.102 0.477 . . . . 0.0 111.632 -178.144 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -71.42 -154.05 1.58 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.731 179.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.74 HD21 ' HA ' ' A' ' 141' ' ' GLN . 7.0 tp -76.79 -42.55 40.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.864 0.364 . . . . 0.0 111.359 -179.659 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.524 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 14.8 pt-20 -63.08 -47.16 84.06 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.819 -179.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.732 ' O ' HD12 ' A' ' 130' ' ' LEU . 0.3 OUTLIER -74.54 -38.83 62.66 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.941 0.401 . . . . 0.0 110.544 -179.741 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.689 ' HB1' HD22 ' A' ' 140' ' ' LEU . . . -64.29 -29.52 70.61 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 121.496 0.665 . . . . 0.0 109.209 178.465 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.426 ' SG ' ' HG3' ' A' ' 137' ' ' LYS . 43.9 m -84.01 -36.35 23.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.611 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.677 ' HG3' ' O ' ' A' ' 126' ' ' GLU . 0.8 OUTLIER -59.35 -44.79 92.63 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.742 -179.95 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.732 HD12 ' O ' ' A' ' 126' ' ' GLU . 1.0 OUTLIER -75.85 -39.69 56.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.701 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.494 ' HB1' ' HB2' ' A' ' 136' ' ' MET . . . -78.9 52.59 1.26 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.176 178.082 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . 0.414 ' HG2' ' H ' ' A' ' 132' ' ' GLN . 0.0 OUTLIER -37.92 -31.57 0.05 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.59 -178.815 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.72 ' HB3' ' OE2' ' A' ' 135' ' ' GLU . 25.5 m-85 -63.18 121.29 13.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.705 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 137' ' ' LYS . 9.3 tttt -46.48 -54.31 9.5 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 121.158 0.504 . . . . 0.0 111.853 -179.494 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.92 ' HB3' HD13 ' A' ' 85' ' ' LEU . 14.0 mp0 -41.29 -54.92 2.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.1 -179.24 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.682 ' O ' HD12 ' A' ' 140' ' ' LEU . 0.0 OUTLIER -63.23 -30.92 71.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.794 0.331 . . . . 0.0 110.613 179.875 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 134' ' ' LYS . 0.3 OUTLIER -58.07 -36.58 73.02 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.602 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -76.99 -46.95 22.15 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.215 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -50.81 -50.82 55.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 CA-C-O 121.074 0.464 . . . . 0.0 110.209 179.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.689 HD22 ' HB1' ' A' ' 127' ' ' ALA . 0.8 OUTLIER -72.15 -32.01 66.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.994 178.798 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.74 ' HA ' HD21 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -59.06 -51.99 67.66 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.893 -179.753 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.459 ' CB ' ' HE2' ' A' ' 81' ' ' PHE . 1.5 mt-10 -69.57 -27.6 65.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.366 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -54.91 -48.62 65.92 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.916 179.42 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . 0.824 ' HE2' ' HB ' ' A' ' 29' ' ' ILE . 0.6 OUTLIER -80.7 -32.72 35.81 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.078 0.466 . . . . 0.0 110.325 179.551 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 142' ' ' GLU . 11.6 tp-100 -65.96 -52.62 48.1 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.972 -179.636 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.652 ' CE1' HD11 ' A' ' 150' ' ' ILE . 24.1 t80 -61.63 -53.48 55.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.622 -179.806 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.514 HD23 ' CD1' ' A' ' 150' ' ' ILE . 92.8 mt -57.61 -29.94 64.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.463 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.83 -24.46 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.546 179.549 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.84 -12.03 49.11 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.24 -179.774 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.652 HD11 ' CE1' ' A' ' 146' ' ' PHE . 1.2 mt -87.25 -128.88 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -150.21 -66.13 0.2 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.798 0.333 . . . . 0.0 110.776 179.977 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -170.09 109.32 0.39 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.85 -179.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.746 ' HB3' HD11 ' A' ' 78' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.956 -179.924 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.764 " C4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.563 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -72.41 -24.99 18.72 Favored 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 124.314 3.343 . . . . 0.0 109.593 -179.915 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 11.3 mt -123.79 -69.94 0.79 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.891 0.377 . . . . 0.0 111.012 -179.87 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 143.78 -85.31 0.19 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.611 -179.949 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -69.69 137.62 52.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.857 0.36 . . . . 0.0 110.966 -179.891 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.512 ' O ' ' HB3' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -91.0 128.32 36.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.938 179.884 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HA ' ' HG2' ' A' ' 93' ' ' PRO . . . 78.58 165.95 0.21 Allowed 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.474 179.461 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.048 HD11 ' HB3' ' A' ' 92' ' ' LYS . 0.0 OUTLIER -108.6 131.58 54.73 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.282 179.912 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.757 ' HB3' HG13 ' A' ' 50' ' ' VAL . 2.5 mtm180 -81.89 128.35 33.95 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.836 -179.825 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 49' ' ' HIS . . . -143.32 156.27 44.66 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.852 179.565 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.556 ' HB2' ' HB ' ' A' ' 59' ' ' THR . 56.9 m -149.3 124.06 9.87 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.002 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.66 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . -117.44 168.91 13.02 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.922 -0.656 . . . . 0.0 111.672 179.152 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.79 HD11 HD23 ' A' ' 61' ' ' LEU . 1.5 mt -118.99 117.68 29.44 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.833 -179.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.978 HD11 ' HB1' ' A' ' 139' ' ' ALA . 38.7 mt -82.18 92.37 2.39 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.574 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 177.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.912 HD11 HG23 ' A' ' 64' ' ' THR . 27.7 mt -86.39 145.57 7.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.783 -177.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.832 ' HB2' ' CG2' ' A' ' 29' ' ' ILE . 44.3 p90 -150.83 123.67 8.64 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -178.967 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.545 ' HG2' HG22 ' A' ' 103' ' ' VAL . 0.0 OUTLIER -82.1 112.53 19.23 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HD3' HG12 ' A' ' 29' ' ' ILE . 0.4 OUTLIER -103.91 120.2 40.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.046 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.36 159.26 19.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.478 179.6 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.1 tp -60.88 -80.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.986 -179.809 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.471 ' O ' HD12 ' A' ' 21' ' ' ILE . 2.8 pp -109.04 149.75 40.05 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.611 0.243 . . . . 0.0 111.046 179.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 21' ' ' ILE . 16.5 Cg_exo -67.29 152.51 79.19 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.571 2.181 . . . . 0.0 112.187 179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.35 -76.15 0.62 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.701 179.835 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 24' ' ' VAL . 18.8 t -99.58 -1.62 9.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.232 179.692 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.5 t70 63.54 40.84 7.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.143 0.497 . . . . 0.0 110.307 -179.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -106.95 -46.0 4.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.179 -179.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -160.54 116.92 2.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.624 -179.95 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -92.63 -51.34 5.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.642 -179.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ILE . . . . . 0.832 ' CG2' ' HB2' ' A' ' 16' ' ' PHE . 4.9 mt -98.64 147.26 7.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 121.205 0.526 . . . . 0.0 112.143 -178.839 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.654 ' O ' ' HA ' ' A' ' 16' ' ' PHE . 3.9 mt-10 -138.92 124.68 19.7 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.776 179.236 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.693 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 55.1 m-85 -88.76 147.1 24.64 Favored 'General case' 0 N--CA 1.463 0.176 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.564 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.657 HD13 ' CE2' ' A' ' 121' ' ' TRP . 45.5 tp -85.87 132.62 34.06 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.843 178.828 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.51 ' CD1' ' HA ' ' A' ' 127' ' ' ALA . 4.4 mt -133.03 144.55 50.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.878 0.37 . . . . 0.0 110.757 -179.84 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.677 HD11 ' HG3' ' A' ' 46' ' ' PRO . 63.4 mt -123.31 106.71 10.93 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.052 -179.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.504 ' HB2' ' CH2' ' A' ' 43' ' ' TRP . 3.1 tt0 -60.02 139.05 57.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.08 -179.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.27 135.48 50.55 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.504 179.347 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.618 ' HA ' ' HB2' ' A' ' 117' ' ' GLN . 92.5 p -81.04 20.91 0.75 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.376 179.967 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -179.42 -173.05 0.25 Allowed 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.102 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 75.89 -135.65 18.31 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.42 -0.895 . . . . 0.0 112.323 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.543 HD11 ' HB3' ' A' ' 42' ' ' HIS . 1.1 pt -87.57 9.99 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.986 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.445 ' HB2' ' O ' ' A' ' 40' ' ' ILE . 0.4 OUTLIER 66.45 38.46 4.26 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.533 0.683 . . . . 0.0 109.637 -179.103 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.752 ' HE2' H5'1 ' A' ' 154' ' ' ATP . 1.8 p-80 -85.82 152.99 22.57 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.922 -179.587 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.654 ' CD1' ' HB3' ' A' ' 130' ' ' LEU . 54.9 m95 -100.05 157.94 16.19 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.093 -179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.6 HG22 ' SD ' ' A' ' 136' ' ' MET . 0.0 OUTLIER -173.19 130.62 0.57 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.221 -179.851 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.419 ' HD2' ' SD ' ' A' ' 136' ' ' MET . 75.0 Cg_exo -50.99 169.12 0.19 Allowed 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.025 1.817 . . . . 0.0 112.091 179.994 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' PRO . . . . . 0.864 ' HB2' ' HA ' ' A' ' 64' ' ' THR . 16.5 Cg_exo -64.25 81.14 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.492 2.128 . . . . 0.0 111.847 179.606 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.66 ' HA ' ' HA2' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -104.55 151.92 23.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.133 -179.786 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.536 ' O ' ' HB1' ' A' ' 10' ' ' ALA . . . -134.65 -172.69 12.87 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.592 -179.814 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 10' ' ' ALA . 3.7 p80 -109.74 110.82 21.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.713 0.292 . . . . 0.0 110.456 179.636 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.757 HG13 ' HB3' ' A' ' 9' ' ' ARG . 1.8 p -79.71 132.97 30.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.507 0.67 . . . . 0.0 111.135 -179.083 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.773 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 2.9 tt0 -91.03 152.79 44.6 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.516 ' HD2' ' CG ' ' A' ' 51' ' ' GLU . 19.6 Cg_endo -57.17 -15.86 19.65 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.647 2.231 . . . . 0.0 112.525 -179.292 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.773 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -106.23 -11.44 27.63 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 178.982 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -87.83 170.92 10.77 Favored 'General case' 0 N--CA 1.457 -0.114 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.977 ' HB3' ' HB2' ' A' ' 58' ' ' GLU . 15.4 t70 -87.52 162.08 17.42 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 179.543 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.513 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . 9.6 m-20 -73.91 -63.5 1.2 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.864 -179.368 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.588 HD21 HG21 ' A' ' 77' ' ' ILE . 23.3 tp -64.63 -39.06 93.03 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 120.685 0.279 . . . . 0.0 110.639 -179.843 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.977 ' HB2' ' HB3' ' A' ' 55' ' ' ASP . 0.4 OUTLIER -50.76 -45.71 59.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.653 179.277 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.556 ' HB ' ' HB2' ' A' ' 11' ' ' CYS . 92.4 m -59.5 -43.46 93.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 121.199 0.523 . . . . 0.0 109.655 179.513 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.554 ' HB2' ' HB3' ' A' ' 11' ' ' CYS . . . -71.39 -29.73 65.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.194 179.163 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.819 HD22 ' HB2' ' A' ' 72' ' ' ALA . 94.1 mt -74.9 -52.97 9.9 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.038 179.537 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.444 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 0.0 OUTLIER -61.13 -38.08 85.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.641 -179.849 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.39 -33.8 76.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 179.025 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.912 HG23 HD11 ' A' ' 15' ' ' ILE . 40.9 m -62.58 -54.71 35.59 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.572 179.44 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.539 ' HA ' ' N ' ' A' ' 70' ' ' ILE . 0.0 OUTLIER -72.47 -25.03 61.28 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.697 179.545 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 3.2 mm-40 -78.06 -33.55 50.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.076 179.53 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HB3' HD13 ' A' ' 34' ' ' LEU . 57.3 mt-10 -112.9 6.94 18.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.959 -179.173 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.628 ' O ' ' HA ' ' A' ' 110' ' ' ILE . . . -154.01 -7.21 0.16 Allowed 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 179.795 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.604 ' CA ' ' HD3' ' A' ' 111' ' ' ARG . . . 72.62 -3.24 26.91 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.364 -0.922 . . . . 0.0 113.461 179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.663 HD11 ' CD1' ' A' ' 110' ' ' ILE . 1.3 mt -101.02 120.69 50.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-O 121.154 0.502 . . . . 0.0 110.97 -179.632 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.428 ' O ' ' HG ' ' A' ' 75' ' ' LEU . 1.1 pt-20 -106.15 170.69 7.77 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.198 -179.217 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.868 ' HA ' HD12 ' A' ' 75' ' ' LEU . . . -49.56 -33.03 13.86 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-O 121.124 0.488 . . . . 0.0 110.251 179.064 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.507 ' O ' ' HE3' ' A' ' 104' ' ' LYS . . . -70.66 -11.46 68.95 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.441 -0.799 . . . . 0.0 112.479 179.837 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.599 HE21 ' HA ' ' A' ' 74' ' ' GLN . 0.0 OUTLIER -113.7 -13.47 12.68 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 116.822 0.311 . . . . 0.0 111.053 179.286 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.868 HD12 ' HA ' ' A' ' 72' ' ' ALA . 0.0 OUTLIER -120.32 -173.13 2.5 Favored 'General case' 0 CA--C 1.527 0.087 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 177.805 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.576 ' H ' ' H ' ' A' ' 102' ' ' GLU . 33.8 m -131.62 98.12 4.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.384 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.735 HD12 HD21 ' A' ' 13' ' ' LEU . 14.8 mm -70.64 102.17 0.91 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.361 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.616 HG21 HD12 ' A' ' 100' ' ' LEU . 1.1 mp -65.3 140.02 20.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.013 0.435 . . . . 0.0 110.437 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -97.83 150.97 20.69 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.555 -179.658 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 103.13 -21.85 38.49 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.651 179.634 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.55 ' CE1' HD21 ' A' ' 100' ' ' LEU . 12.3 t80 -108.93 126.17 52.8 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 120.816 0.341 . . . . 0.0 111.368 -179.59 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.687 ' HD2' ' CZ2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER -158.8 134.29 8.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.188 179.51 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -157.78 145.66 18.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.741 179.465 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.873 ' HB3' HD13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -123.48 136.18 54.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 179.561 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.904 HD13 ' CB ' ' A' ' 135' ' ' GLU . 10.8 mt -100.01 119.09 37.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.097 179.761 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.7 118.64 37.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.466 -178.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.536 ' CD2' ' HG2' ' A' ' 135' ' ' GLU . 17.1 p90 -167.22 147.41 5.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.012 179.748 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.636 HG23 ' C ' ' A' ' 92' ' ' LYS . 9.9 p -83.81 112.88 21.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.47 0.652 . . . . 0.0 110.216 179.232 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.859 ' HB1' " H4'" ' A' ' 154' ' ' ATP . . . -79.85 -100.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.761 -178.494 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.45 -45.84 88.99 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-O 121.143 0.497 . . . . 0.0 110.241 179.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.523 ' O ' ' HD2' ' A' ' 92' ' ' LYS . 1.1 t30 -174.74 21.82 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.218 179.531 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 1.048 ' HB3' HD11 ' A' ' 8' ' ' LEU . 7.8 tptt -151.25 130.91 6.73 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.906 0.384 . . . . 0.0 110.848 -179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.868 ' O ' HD12 ' A' ' 8' ' ' LEU . 48.2 Cg_endo -67.74 118.61 5.73 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.388 2.725 . . . . 0.0 112.554 -179.436 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 1.016 ' HG2' HD13 ' A' ' 8' ' ' LEU . 8.5 mtpp -106.15 123.37 47.92 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.42 -0.809 . . . . 0.0 112.65 -178.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 52.8 m -89.21 105.75 17.99 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 177.292 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.718 ' O ' ' HA ' ' A' ' 84' ' ' GLU . 20.3 t -105.7 108.19 24.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.873 HD13 ' HB3' ' A' ' 84' ' ' GLU . 1.3 mm -87.41 126.55 41.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 109.144 -0.688 . . . . 0.0 109.144 178.062 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.784 ' HB3' HG13 ' A' ' 14' ' ' ILE . 39.1 m-85 -114.9 128.88 56.55 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.109 0.481 . . . . 0.0 111.76 -178.775 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.687 ' CZ2' ' HD2' ' A' ' 82' ' ' LYS . 0.3 OUTLIER -113.29 147.24 37.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.106 179.198 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.616 HD12 HG21 ' A' ' 78' ' ' ILE . 12.9 mt -78.37 132.93 37.58 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.719 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . 0.647 ' HB2' HD13 ' A' ' 77' ' ' ILE . . . -142.71 144.57 32.75 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.908 0.385 . . . . 0.0 111.286 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.576 ' H ' ' H ' ' A' ' 76' ' ' THR . 2.3 tm-20 -124.6 114.7 19.72 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.491 179.153 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.76 HG12 HD23 ' A' ' 75' ' ' LEU . 5.1 m -71.85 123.7 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 CA-C-O 121.376 0.607 . . . . 0.0 110.065 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.507 ' HE3' ' O ' ' A' ' 73' ' ' GLY . 1.4 mttm -60.13 -28.58 68.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.29 -177.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.718 ' HB3' ' HB ' ' A' ' 108' ' ' VAL . 63.3 t0 -102.11 121.35 42.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.079 0.466 . . . . 0.0 111.722 -178.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -59.77 -43.63 94.28 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.81 179.215 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -99.66 25.9 6.71 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.703 178.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.718 ' HB ' ' HB3' ' A' ' 105' ' ' ASP . 4.8 p -42.99 151.39 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.122 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.332 -179.889 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.408 ' HG3' ' HD2' ' A' ' 111' ' ' ARG . 6.3 pm0 -69.95 141.85 52.97 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.174 0.511 . . . . 0.0 111.233 -179.209 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.851 HG21 ' CD1' ' A' ' 119' ' ' TYR . 37.3 mm -120.34 98.01 5.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.808 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' ARG . . . . . 0.604 ' HD3' ' CA ' ' A' ' 69' ' ' GLY . 3.3 mtp180 -98.32 97.51 8.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.554 -179.128 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.641 HD22 HD22 ' A' ' 34' ' ' LEU . 10.2 mt -92.66 125.51 37.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.736 179.659 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.405 ' C ' ' H ' ' A' ' 115' ' ' GLU . 54.5 m -82.8 -166.38 1.3 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.357 179.707 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.5 m-70 -75.7 19.47 0.2 Allowed 'General case' 0 CA--C 1.53 0.201 0 CA-C-O 120.64 0.257 . . . . 0.0 111.329 179.784 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' A' ' 113' ' ' SER . 50.7 mt-10 -105.26 -34.11 7.99 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 120.788 0.327 . . . . 0.0 110.626 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.615 ' CG ' ' HB3' ' A' ' 34' ' ' LEU . 11.0 m80 -118.1 137.32 53.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.934 -179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.618 ' HB2' ' HA ' ' A' ' 37' ' ' SER . 8.1 tp-100 -85.27 -27.29 26.1 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.842 -179.437 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -169.0 174.35 6.39 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.938 0.399 . . . . 0.0 111.583 -179.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.851 ' CD1' HG21 ' A' ' 110' ' ' ILE . 23.6 p90 -136.97 174.01 11.08 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.509 -179.266 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.453 ' HG3' ' CH2' ' A' ' 43' ' ' TRP . 1.7 mtt-85 -157.94 162.38 38.26 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.215 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' TRP . . . . . 0.657 ' CE2' HD13 ' A' ' 32' ' ' LEU . 91.0 m95 -131.0 107.16 8.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.861 179.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.825 HD22 ' HB3' ' A' ' 126' ' ' GLU . 0.0 OUTLIER -138.89 172.36 12.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.012 0.434 . . . . 0.0 111.42 -178.838 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -78.81 -151.7 5.95 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.732 -0.746 . . . . 0.0 111.665 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 141' ' ' GLN . 5.5 tp -77.53 -39.74 45.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.797 0.332 . . . . 0.0 111.187 179.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.502 ' HG3' ' N ' ' A' ' 126' ' ' GLU . 16.8 pt-20 -63.03 -50.62 69.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.797 -179.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . 0.825 ' HB3' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -71.39 -46.9 59.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.111 -179.564 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.51 ' HA ' ' CD1' ' A' ' 33' ' ' LEU . . . -56.11 -27.55 54.29 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.225 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' CYS . . . . . 0.498 ' SG ' ' HG2' ' A' ' 137' ' ' LYS . 0.7 OUTLIER -82.5 -31.77 29.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.647 178.58 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.726 HE21 ' HG ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -65.99 -45.24 82.34 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.096 -179.676 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.726 ' HG ' HE21 ' A' ' 129' ' ' GLN . 0.5 OUTLIER -78.47 -40.01 36.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.359 179.239 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.55 ' HB1' ' CB ' ' A' ' 136' ' ' MET . . . -73.72 49.48 0.31 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.771 179.583 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.82 -31.23 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.486 -0.779 . . . . 0.0 112.151 -179.182 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.505 ' CZ ' ' C8 ' ' A' ' 154' ' ' ATP . 11.4 m-85 -61.6 118.75 7.47 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.83 0.348 . . . . 0.0 110.7 179.959 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -46.24 -38.11 8.06 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.904 ' CB ' HD13 ' A' ' 85' ' ' LEU . 1.8 mp0 -59.65 -56.98 15.08 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.273 -179.391 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 136' ' ' MET . . . . . 0.6 ' SD ' HG22 ' A' ' 44' ' ' THR . 0.0 OUTLIER -54.33 -45.13 72.58 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.028 -179.406 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 137' ' ' LYS . . . . . 0.574 ' O ' ' HB2' ' A' ' 141' ' ' GLN . 0.0 OUTLIER -52.06 -35.3 46.98 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.591 179.672 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.522 ' HA ' ' HB2' ' A' ' 141' ' ' GLN . . . -77.47 -46.51 22.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.681 179.882 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 139' ' ' ALA . . . . . 0.978 ' HB1' HD11 ' A' ' 14' ' ' ILE . . . -53.11 -48.36 67.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.442 179.425 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.463 HD12 ' O ' ' A' ' 136' ' ' MET . 0.7 OUTLIER -74.48 -25.98 59.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.092 178.854 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.574 ' HB2' ' O ' ' A' ' 137' ' ' LYS . 0.0 OUTLIER -66.46 -51.83 52.65 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.09 179.942 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 142' ' ' GLU . . . . . 0.499 ' HB2' ' CZ ' ' A' ' 81' ' ' PHE . 10.0 mm-40 -69.93 -28.74 65.84 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.513 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . . . . . . . . . . . -57.75 -45.8 93.01 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.04 179.405 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 144' ' ' HIS . . . . . . . . . . . . . 5.7 t-80 -76.11 -28.84 57.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.342 179.394 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -70.6 -50.1 40.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.091 -179.888 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 146' ' ' PHE . . . . . 0.571 ' CE1' HD11 ' A' ' 150' ' ' ILE . 18.5 t80 -67.8 -52.08 41.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.149 -179.667 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.521 HD23 ' CD1' ' A' ' 150' ' ' ILE . 96.1 mt -57.27 -27.71 62.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.529 -179.614 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 148' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.53 -21.73 66.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.683 179.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 149' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.43 -6.63 56.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.895 -179.687 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.571 HD11 ' CE1' ' A' ' 146' ' ' PHE . 1.1 mt -96.87 -131.85 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 N-CA-C 110.47 -0.196 . . . . 0.0 110.47 -179.893 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -175.77 -72.94 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.86 0.362 . . . . 0.0 110.842 179.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 152' ' ' ALA . . . . . . . . . . . . . . . -176.49 -179.12 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.922 179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.036 -179.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 154' ' ' ATP . . . . . 0.859 " H4'" ' HB1' ' A' ' 89' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_